A1IN5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C9 | O3 | sing | 1.44Å | 1.44Å | |
| C9 | C10 | sing | 1.51Å | 1.51Å | |
| O3 | C8 | sing | 1.38Å | 1.38Å | |
| C10 | C11 | doub | 1.34Å | 1.34Å | |
| O1 | C1 | sing | 1.43Å | 1.43Å | |
| O1 | C2 | sing | 1.37Å | 1.37Å | |
| C11 | C12 | sing | 1.48Å | 1.48Å | |
| C8 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| O2 | C7 | sing | 1.42Å | 1.42Å | |
| O2 | C6 | sing | 1.36Å | 1.36Å | |
| C2 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | O4 | sing | 1.47Å | 1.47Å | |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C21 | sing | 1.51Å | 1.51Å | |
| O4 | C14 | sing | 1.35Å | 1.35Å | |
| C23 | C24 | sing | 1.50Å | 1.50Å | |
| C23 | C22 | sing | 1.54Å | 1.54Å | |
| C24 | C25 | sing | 1.52Å | 1.52Å | |
| C21 | C22 | sing | 1.54Å | 1.54Å | |
| C21 | C20 | sing | 1.49Å | 1.49Å | |
| C14 | O5 | doub | 1.19Å | 1.19Å | |
| C14 | C15 | sing | 1.51Å | 1.51Å | |
| C19 | N1 | sing | 1.48Å | 1.48Å | |
| C19 | C18 | sing | 1.51Å | 1.51Å | |
| C22 | C27 | sing | 1.52Å | 1.52Å | |
| C20 | O6 | doub | 1.23Å | 1.23Å | |
| C20 | N1 | sing | 1.36Å | 1.36Å | |
| N1 | C15 | sing | 1.46Å | 1.46Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C25 | C26 | sing | 1.50Å | 1.50Å | |
| C18 | C17 | sing | 1.49Å | 1.49Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C27 | C26 | sing | 1.55Å | 1.55Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H12 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.10Å | 1.10Å | |
| C7 | H8 | sing | 1.10Å | 1.10Å | |
| C7 | H6 | sing | 1.10Å | 1.10Å | |
| C9 | H9 | sing | 1.10Å | 1.10Å | |
| C9 | H10 | sing | 1.10Å | 1.10Å | |
| C10 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H13 | sing | 1.10Å | 1.10Å | |
| C12 | H14 | sing | 1.10Å | 1.10Å | |
| C13 | H15 | sing | 1.10Å | 1.10Å | |
| C13 | H16 | sing | 1.10Å | 1.10Å | |
| C3 | H4 | sing | 1.08Å | 1.08Å | |
| C1 | H2 | sing | 1.10Å | 1.10Å | |
| C1 | H3 | sing | 1.10Å | 1.10Å | |
| C1 | H1 | sing | 1.10Å | 1.10Å | |
| C15 | H17 | sing | 1.10Å | 1.10Å | |
| C16 | H18 | sing | 1.10Å | 1.10Å | |
| C16 | H19 | sing | 1.10Å | 1.10Å | |
| C17 | H21 | sing | 1.10Å | 1.10Å | |
| C17 | H20 | sing | 1.10Å | 1.10Å | |
| C18 | H23 | sing | 1.10Å | 1.10Å | |
| C18 | H22 | sing | 1.10Å | 1.10Å | |
| C19 | H25 | sing | 1.10Å | 1.10Å | |
| C19 | H24 | sing | 1.10Å | 1.10Å | |
| C21 | H26 | sing | 1.10Å | 1.10Å | |
| C22 | H27 | sing | 1.10Å | 1.10Å | |
| C23 | H29 | sing | 1.10Å | 1.10Å | |
| C23 | H28 | sing | 1.10Å | 1.10Å | |
| C24 | H30 | sing | 1.10Å | 1.10Å | |
| C24 | H31 | sing | 1.10Å | 1.10Å | |
| C25 | H32 | sing | 1.10Å | 1.10Å | |
| C25 | H33 | sing | 1.10Å | 1.10Å | |
| C26 | H34 | sing | 1.10Å | 1.10Å | |
| C26 | H35 | sing | 1.10Å | 1.10Å | |
| C27 | H37 | sing | 1.10Å | 1.10Å | |
| C27 | H36 | sing | 1.10Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C9 | C10 | 111.7° | 111.7° |
| C9 | O3 | C8 | 119.0° | 119.0° |
| O3 | C9 | H9 | 108.9° | 108.9° |
| O3 | C9 | H10 | 108.9° | 108.9° |
| C9 | C10 | C11 | 124.1° | 124.1° |
| C10 | C9 | H9 | 108.9° | 108.9° |
| C10 | C9 | H10 | 108.9° | 108.9° |
| C9 | C10 | H11 | 117.9° | 117.9° |
| O3 | C8 | C2 | 121.0° | 121.0° |
| O3 | C8 | C6 | 119.8° | 119.8° |
| C10 | C11 | C12 | 131.6° | 131.6° |
| C10 | C11 | H12 | 114.2° | 114.2° |
| C11 | C10 | H11 | 117.9° | 117.9° |
| C1 | O1 | C2 | 119.5° | 119.5° |
| O1 | C1 | H2 | 109.5° | 109.5° |
| O1 | C1 | H3 | 109.5° | 109.5° |
| O1 | C1 | H1 | 109.5° | 109.5° |
| O1 | C2 | C8 | 113.1° | 113.1° |
| O1 | C2 | C3 | 126.0° | 126.0° |
| C11 | C12 | C13 | 112.9° | 112.9° |
| C12 | C11 | H12 | 114.2° | 114.2° |
| C11 | C12 | H13 | 108.6° | 108.6° |
| C11 | C12 | H14 | 108.6° | 108.6° |
| C2 | C8 | C6 | 119.2° | 119.2° |
| C8 | C2 | C3 | 120.6° | 120.6° |
| C8 | C6 | O2 | 114.6° | 114.6° |
| C8 | C6 | C5 | 120.3° | 120.3° |
| C7 | O2 | C6 | 119.4° | 119.4° |
| O2 | C7 | H7 | 109.5° | 109.5° |
| O2 | C7 | H8 | 109.5° | 109.5° |
| O2 | C7 | H6 | 109.5° | 109.5° |
| O2 | C6 | C5 | 124.8° | 124.8° |
| C2 | C3 | C4 | 119.6° | 119.6° |
| C2 | C3 | H4 | 120.2° | 120.2° |
| C6 | C5 | C4 | 120.6° | 120.6° |
| C6 | C5 | H5 | 119.7° | 119.7° |
| C12 | C13 | O4 | 109.1° | 109.1° |
| C13 | C12 | H13 | 108.6° | 108.6° |
| C13 | C12 | H14 | 108.6° | 108.6° |
| C12 | C13 | H15 | 109.5° | 109.5° |
| C12 | C13 | H16 | 109.6° | 109.6° |
| C3 | C4 | C5 | 119.5° | 119.5° |
| C3 | C4 | C21 | 121.6° | 121.6° |
| C4 | C3 | H4 | 120.2° | 120.2° |
| C13 | O4 | C14 | 120.6° | 120.6° |
| O4 | C13 | H15 | 109.6° | 109.6° |
| O4 | C13 | H16 | 109.6° | 109.6° |
| C5 | C4 | C21 | 118.8° | 118.8° |
| C4 | C5 | H5 | 119.7° | 119.7° |
| C4 | C21 | C22 | 116.0° | 116.0° |
| C4 | C21 | C20 | 103.9° | 103.9° |
| C4 | C21 | H26 | 108.3° | 108.3° |
| O4 | C14 | O5 | 126.0° | 126.0° |
| O4 | C14 | C15 | 114.5° | 114.5° |
| C24 | C23 | C22 | 114.1° | 114.1° |
| C23 | C24 | C25 | 111.9° | 111.9° |
| C24 | C23 | H29 | 108.3° | 108.3° |
| C24 | C23 | H28 | 108.3° | 108.3° |
| C23 | C24 | H30 | 108.8° | 108.8° |
| C23 | C24 | H31 | 108.9° | 108.9° |
| C23 | C22 | C21 | 110.3° | 110.3° |
| C23 | C22 | C27 | 109.7° | 109.7° |
| C23 | C22 | H27 | 108.5° | 108.5° |
| C22 | C23 | H29 | 108.3° | 108.3° |
| C22 | C23 | H28 | 108.3° | 108.3° |
| C24 | C25 | C26 | 112.7° | 112.7° |
| C25 | C24 | H30 | 108.9° | 108.9° |
| C25 | C24 | H31 | 108.8° | 108.9° |
| C24 | C25 | H32 | 108.6° | 108.6° |
| C24 | C25 | H33 | 108.7° | 108.7° |
| C22 | C21 | C20 | 112.0° | 112.0° |
| C21 | C22 | C27 | 111.0° | 111.0° |
| C22 | C21 | H26 | 107.9° | 107.9° |
| C21 | C22 | H27 | 108.5° | 108.5° |
| C21 | C20 | O6 | 119.6° | 119.6° |
| C21 | C20 | N1 | 117.9° | 117.9° |
| C20 | C21 | H26 | 108.5° | 108.5° |
| O5 | C14 | C15 | 119.4° | 119.4° |
| C14 | C15 | N1 | 108.9° | 108.9° |
| C14 | C15 | C16 | 109.2° | 109.2° |
| C14 | C15 | H17 | 108.8° | 108.8° |
| N1 | C19 | C18 | 111.7° | 111.7° |
| C19 | N1 | C20 | 125.7° | 125.7° |
| C19 | N1 | C15 | 119.4° | 119.4° |
| N1 | C19 | H25 | 108.9° | 108.9° |
| N1 | C19 | H24 | 108.9° | 108.9° |
| C19 | C18 | C17 | 110.0° | 110.0° |
| C19 | C18 | H23 | 109.3° | 109.3° |
| C19 | C18 | H22 | 109.4° | 109.4° |
| C18 | C19 | H25 | 108.9° | 108.9° |
| C18 | C19 | H24 | 108.9° | 108.9° |
| C22 | C27 | C26 | 111.3° | 111.3° |
| C27 | C22 | H27 | 108.7° | 108.7° |
| C22 | C27 | H37 | 109.0° | 109.0° |
| C22 | C27 | H36 | 109.0° | 109.0° |
| O6 | C20 | N1 | 122.2° | 122.2° |
| C20 | N1 | C15 | 114.6° | 114.6° |
| N1 | C15 | C16 | 112.0° | 112.0° |
| N1 | C15 | H17 | 109.4° | 109.4° |
| C15 | C16 | C17 | 110.2° | 110.2° |
| C16 | C15 | H17 | 108.5° | 108.5° |
| C15 | C16 | H18 | 109.3° | 109.3° |
| C15 | C16 | H19 | 109.3° | 109.3° |
| C25 | C26 | C27 | 111.8° | 111.8° |
| C26 | C25 | H32 | 108.7° | 108.7° |
| C26 | C25 | H33 | 108.7° | 108.7° |
| C25 | C26 | H34 | 108.9° | 108.9° |
| C25 | C26 | H35 | 108.9° | 108.9° |
| C18 | C17 | C16 | 111.2° | 111.2° |
| C18 | C17 | H21 | 109.1° | 109.1° |
| C18 | C17 | H20 | 109.0° | 109.0° |
| C17 | C18 | H23 | 109.3° | 109.3° |
| C17 | C18 | H22 | 109.3° | 109.3° |
| C17 | C16 | H18 | 109.3° | 109.3° |
| C17 | C16 | H19 | 109.3° | 109.3° |
| C16 | C17 | H21 | 109.0° | 109.0° |
| C16 | C17 | H20 | 109.0° | 109.0° |
| C27 | C26 | H34 | 108.9° | 108.9° |
| C27 | C26 | H35 | 108.9° | 108.9° |
| C26 | C27 | H37 | 109.0° | 109.0° |
| C26 | C27 | H36 | 109.0° | 109.0° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H7 | C7 | H6 | 109.4° | 109.4° |
| H8 | C7 | H6 | 109.5° | 109.5° |
| H9 | C9 | H10 | 109.5° | 109.5° |
| H13 | C12 | H14 | 109.4° | 109.5° |
| H15 | C13 | H16 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H1 | 109.5° | 109.5° |
| H3 | C1 | H1 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.5° |
| H21 | C17 | H20 | 109.4° | 109.4° |
| H23 | C18 | H22 | 109.5° | 109.5° |
| H25 | C19 | H24 | 109.5° | 109.4° |
| H29 | C23 | H28 | 109.5° | 109.5° |
| H30 | C24 | H31 | 109.5° | 109.5° |
| H32 | C25 | H33 | 109.4° | 109.4° |
| H34 | C26 | H35 | 109.5° | 109.5° |
| H37 | C27 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C9 | C10 | H9 | 120.3° | 120.3° |
| O3 | C9 | C10 | H10 | 120.4° | 120.4° |
| O3 | C9 | C10 | C11 | 101.0° | 101.0° |
| C9 | O3 | C8 | C2 | 82.5° | 82.5° |
| C9 | O3 | C8 | C6 | 95.1° | 95.1° |
| O3 | C9 | H9 | H10 | 119.0° | 119.0° |
| O3 | C9 | C10 | H11 | 79.0° | 79.0° |
| C10 | C9 | O3 | C8 | 14.5° | 14.5° |
| C9 | C10 | C11 | H11 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 171.9° | 171.9° |
| C9 | C10 | C11 | H12 | 8.1° | 8.1° |
| C10 | C9 | H9 | H10 | 119.0° | 119.0° |
| O3 | C8 | C2 | O1 | 2.3° | 2.3° |
| O3 | C8 | C2 | C6 | 177.6° | 177.6° |
| O3 | C8 | C6 | O2 | 4.5° | 4.5° |
| O3 | C8 | C2 | C3 | 176.9° | 176.9° |
| O3 | C8 | C6 | C5 | 179.0° | 179.0° |
| C8 | O3 | C9 | H9 | 134.8° | 134.8° |
| C8 | O3 | C9 | H10 | 105.9° | 105.9° |
| C10 | C11 | C12 | H12 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 134.0° | 134.0° |
| C11 | C10 | C9 | H9 | 138.7° | 138.7° |
| C11 | C10 | C9 | H10 | 19.4° | 19.4° |
| C10 | C11 | C12 | H13 | 13.5° | 13.5° |
| C10 | C11 | C12 | H14 | 105.5° | 105.5° |
| C1 | O1 | C2 | C8 | 175.0° | 175.0° |
| C1 | O1 | C2 | C3 | 10.7° | 10.7° |
| O1 | C1 | H2 | H3 | 120.0° | 120.0° |
| O1 | C1 | H2 | H1 | 120.0° | 120.0° |
| O1 | C1 | H3 | H1 | 120.0° | 120.0° |
| O1 | C2 | C8 | C3 | 174.7° | 174.7° |
| O1 | C2 | C8 | C6 | 175.4° | 175.4° |
| O1 | C2 | C3 | C4 | 176.5° | 176.5° |
| O1 | C2 | C3 | H4 | 3.5° | 3.5° |
| C2 | O1 | C1 | H2 | 180.0° | 180.0° |
| C2 | O1 | C1 | H3 | 60.0° | 60.0° |
| C2 | O1 | C1 | H1 | 60.0° | 60.0° |
| C11 | C12 | C13 | H13 | 120.5° | 120.5° |
| C11 | C12 | C13 | H14 | 120.5° | 120.5° |
| C11 | C12 | C13 | O4 | 105.2° | 105.2° |
| C12 | C11 | C10 | H11 | 8.1° | 8.1° |
| C11 | C12 | H13 | H14 | 118.5° | 118.5° |
| C11 | C12 | C13 | H15 | 134.9° | 134.9° |
| C11 | C12 | C13 | H16 | 14.8° | 14.8° |
| C2 | C8 | C6 | O2 | 177.8° | 177.8° |
| C2 | C8 | C6 | C5 | 3.3° | 3.3° |
| C8 | C2 | C3 | C4 | 2.6° | 2.6° |
| C8 | C2 | C3 | H4 | 177.4° | 177.4° |
| C8 | C6 | O2 | C7 | 132.9° | 132.9° |
| C8 | C6 | O2 | C5 | 174.2° | 174.2° |
| C6 | C8 | C2 | C3 | 0.7° | 0.7° |
| C8 | C6 | C5 | C4 | 5.5° | 5.5° |
| C8 | C6 | C5 | H5 | 174.5° | 174.5° |
| C7 | O2 | C6 | C5 | 52.8° | 52.8° |
| O2 | C7 | H7 | H8 | 120.0° | 120.0° |
| O2 | C7 | H7 | H6 | 120.0° | 120.0° |
| O2 | C7 | H8 | H6 | 120.0° | 120.0° |
| O2 | C6 | C5 | C4 | 179.4° | 179.4° |
| O2 | C6 | C5 | H5 | 0.6° | 0.6° |
| C6 | O2 | C7 | H7 | 180.0° | 180.0° |
| C6 | O2 | C7 | H8 | 60.0° | 60.0° |
| C6 | O2 | C7 | H6 | 60.0° | 60.0° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.4° | 0.4° |
| C2 | C3 | C4 | C21 | 175.8° | 175.8° |
| C6 | C5 | C4 | C3 | 3.5° | 3.5° |
| C6 | C5 | C4 | H5 | 180.0° | 180.0° |
| C6 | C5 | C4 | C21 | 179.9° | 179.9° |
| C12 | C13 | O4 | H15 | 119.9° | 119.9° |
| C12 | C13 | O4 | H16 | 120.0° | 120.0° |
| C12 | C13 | O4 | C14 | 128.6° | 128.6° |
| C13 | C12 | C11 | H12 | 46.0° | 46.0° |
| C13 | C12 | H13 | H14 | 118.4° | 118.4° |
| C12 | C13 | H15 | H16 | 120.2° | 120.2° |
| C3 | C4 | C5 | C21 | 176.4° | 176.4° |
| C3 | C4 | C21 | C22 | 66.9° | 66.9° |
| C3 | C4 | C21 | C20 | 56.5° | 56.5° |
| C3 | C4 | C5 | H5 | 176.4° | 176.4° |
| C3 | C4 | C21 | H26 | 171.7° | 171.7° |
| C13 | O4 | C14 | O5 | 2.0° | 2.0° |
| C13 | O4 | C14 | C15 | 179.4° | 179.4° |
| O4 | C13 | C12 | H13 | 15.4° | 15.3° |
| O4 | C13 | C12 | H14 | 134.3° | 134.3° |
| O4 | C13 | H15 | H16 | 120.2° | 120.2° |
| C5 | C4 | C21 | C22 | 109.3° | 109.3° |
| C5 | C4 | C21 | C20 | 127.3° | 127.3° |
| C5 | C4 | C3 | H4 | 179.5° | 179.5° |
| C5 | C4 | C21 | H26 | 12.0° | 12.0° |
| C4 | C21 | C22 | C23 | 45.6° | 45.6° |
| C4 | C21 | C22 | C20 | 119.1° | 119.1° |
| C4 | C21 | C22 | H26 | 121.6° | 121.6° |
| C4 | C21 | C20 | H26 | 115.1° | 115.1° |
| C4 | C21 | C22 | C27 | 167.4° | 167.4° |
| C4 | C21 | C20 | O6 | 96.0° | 96.0° |
| C4 | C21 | C20 | N1 | 77.8° | 77.8° |
| C21 | C4 | C5 | H5 | 0.1° | 0.1° |
| C21 | C4 | C3 | H4 | 4.2° | 4.2° |
| C4 | C21 | C22 | H27 | 73.1° | 73.1° |
| O4 | C14 | O5 | C15 | 177.3° | 177.3° |
| O4 | C14 | C15 | N1 | 2.3° | 2.3° |
| O4 | C14 | C15 | C16 | 124.8° | 124.8° |
| C14 | O4 | C13 | H15 | 8.7° | 8.7° |
| C14 | O4 | C13 | H16 | 111.4° | 111.4° |
| O4 | C14 | C15 | H17 | 116.9° | 116.9° |
| C24 | C23 | C22 | H29 | 120.7° | 120.7° |
| C24 | C23 | C22 | H28 | 120.7° | 120.7° |
| C23 | C24 | C25 | H30 | 120.3° | 120.3° |
| C23 | C24 | C25 | H31 | 120.4° | 120.4° |
| C24 | C23 | C22 | C21 | 176.7° | 176.7° |
| C24 | C23 | C22 | C27 | 54.1° | 54.1° |
| C23 | C24 | C25 | C26 | 50.9° | 50.9° |
| C24 | C23 | C22 | H27 | 64.5° | 64.5° |
| C24 | C23 | H29 | H28 | 117.9° | 117.9° |
| C23 | C24 | H30 | H31 | 118.9° | 118.9° |
| C23 | C24 | C25 | H32 | 171.5° | 171.5° |
| C23 | C24 | C25 | H33 | 69.6° | 69.6° |
| C22 | C23 | C24 | C25 | 51.9° | 51.9° |
| C23 | C22 | C21 | C27 | 121.8° | 121.8° |
| C23 | C22 | C21 | H27 | 118.8° | 118.8° |
| C23 | C22 | C21 | C20 | 164.7° | 164.7° |
| C23 | C22 | C27 | H27 | 118.5° | 118.5° |
| C23 | C22 | C27 | C26 | 54.6° | 54.6° |
| C23 | C22 | C21 | H26 | 76.0° | 76.0° |
| C22 | C23 | H29 | H28 | 117.9° | 117.9° |
| C22 | C23 | C24 | H30 | 68.5° | 68.5° |
| C22 | C23 | C24 | H31 | 172.2° | 172.3° |
| C23 | C22 | C27 | H37 | 65.6° | 65.6° |
| C23 | C22 | C27 | H36 | 174.9° | 174.9° |
| C24 | C25 | C26 | H32 | 120.5° | 120.5° |
| C24 | C25 | C26 | H33 | 120.5° | 120.5° |
| C24 | C25 | C26 | C27 | 52.9° | 52.9° |
| C25 | C24 | C23 | H29 | 68.8° | 68.8° |
| C25 | C24 | C23 | H28 | 172.6° | 172.6° |
| C25 | C24 | H30 | H31 | 118.9° | 118.9° |
| C24 | C25 | H32 | H33 | 118.5° | 118.5° |
| C24 | C25 | C26 | H34 | 67.4° | 67.4° |
| C24 | C25 | C26 | H35 | 173.3° | 173.3° |
| C22 | C21 | C20 | H26 | 119.0° | 119.0° |
| C21 | C22 | C27 | H27 | 119.3° | 119.3° |
| C22 | C21 | C20 | O6 | 29.9° | 29.9° |
| C22 | C21 | C20 | N1 | 156.2° | 156.2° |
| C21 | C22 | C27 | C26 | 176.9° | 176.9° |
| C21 | C22 | C23 | H29 | 56.0° | 56.0° |
| C21 | C22 | C23 | H28 | 62.6° | 62.6° |
| C21 | C22 | C27 | H37 | 56.6° | 56.6° |
| C21 | C22 | C27 | H36 | 62.9° | 62.9° |
| C21 | C20 | N1 | C19 | 8.1° | 8.1° |
| C20 | C21 | C22 | C27 | 73.5° | 73.5° |
| C21 | C20 | O6 | N1 | 173.6° | 173.6° |
| C21 | C20 | N1 | C15 | 178.6° | 178.6° |
| C20 | C21 | C22 | H27 | 45.9° | 45.9° |
| O5 | C14 | C15 | N1 | 179.9° | 179.9° |
| O5 | C14 | C15 | C16 | 57.6° | 57.6° |
| O5 | C14 | C15 | H17 | 60.7° | 60.7° |
| C14 | C15 | N1 | C19 | 78.1° | 78.1° |
| C14 | C15 | N1 | C20 | 95.6° | 95.6° |
| C14 | C15 | N1 | C16 | 120.8° | 120.8° |
| C14 | C15 | N1 | H17 | 118.8° | 118.8° |
| C14 | C15 | C16 | H17 | 118.5° | 118.5° |
| C14 | C15 | C16 | C17 | 73.5° | 73.5° |
| C14 | C15 | C16 | H18 | 46.6° | 46.6° |
| C14 | C15 | C16 | H19 | 166.4° | 166.4° |
| N1 | C19 | C18 | H25 | 120.3° | 120.4° |
| N1 | C19 | C18 | H24 | 120.3° | 120.3° |
| C19 | N1 | C20 | O6 | 165.5° | 165.5° |
| C19 | N1 | C20 | C15 | 173.2° | 173.2° |
| C19 | N1 | C15 | C16 | 42.6° | 42.6° |
| N1 | C19 | C18 | C17 | 52.2° | 52.2° |
| C19 | N1 | C15 | H17 | 163.0° | 163.0° |
| N1 | C19 | C18 | H23 | 67.9° | 67.9° |
| N1 | C19 | C18 | H22 | 172.2° | 172.2° |
| N1 | C19 | H25 | H24 | 119.0° | 119.0° |
| C18 | C19 | N1 | C20 | 142.0° | 142.0° |
| C18 | C19 | N1 | C15 | 45.1° | 45.1° |
| C19 | C18 | C17 | H23 | 120.1° | 120.1° |
| C19 | C18 | C17 | H22 | 120.1° | 120.1° |
| C19 | C18 | C17 | C16 | 61.0° | 61.0° |
| C19 | C18 | C17 | H21 | 178.7° | 178.7° |
| C19 | C18 | C17 | H20 | 59.2° | 59.2° |
| C19 | C18 | H23 | H22 | 119.8° | 119.8° |
| C18 | C19 | H25 | H24 | 119.0° | 119.0° |
| C22 | C27 | C26 | C25 | 55.6° | 55.6° |
| C22 | C27 | C26 | H37 | 120.3° | 120.3° |
| C22 | C27 | C26 | H36 | 120.3° | 120.3° |
| C27 | C22 | C21 | H26 | 45.8° | 45.8° |
| C27 | C22 | C23 | H29 | 66.6° | 66.6° |
| C27 | C22 | C23 | H28 | 174.8° | 174.8° |
| C22 | C27 | C26 | H34 | 64.7° | 64.7° |
| C22 | C27 | C26 | H35 | 176.0° | 176.0° |
| C22 | C27 | H37 | H36 | 119.2° | 119.2° |
| O6 | C20 | N1 | C15 | 7.7° | 7.7° |
| O6 | C20 | C21 | H26 | 148.9° | 148.9° |
| C20 | N1 | C15 | C16 | 143.7° | 143.7° |
| C20 | N1 | C15 | H17 | 23.3° | 23.3° |
| C20 | N1 | C19 | H25 | 21.7° | 21.6° |
| C20 | N1 | C19 | H24 | 97.7° | 97.7° |
| N1 | C20 | C21 | H26 | 37.2° | 37.2° |
| N1 | C15 | C16 | H17 | 120.9° | 120.9° |
| N1 | C15 | C16 | C17 | 47.1° | 47.1° |
| N1 | C15 | C16 | H18 | 167.3° | 167.3° |
| N1 | C15 | C16 | H19 | 72.9° | 72.9° |
| C15 | N1 | C19 | H25 | 165.4° | 165.4° |
| C15 | N1 | C19 | H24 | 75.2° | 75.2° |
| C15 | C16 | C17 | C18 | 58.4° | 58.4° |
| C15 | C16 | C17 | H18 | 120.1° | 120.1° |
| C15 | C16 | C17 | H19 | 120.1° | 120.1° |
| C15 | C16 | H18 | H19 | 119.7° | 119.7° |
| C15 | C16 | C17 | H21 | 178.7° | 178.7° |
| C15 | C16 | C17 | H20 | 61.9° | 61.9° |
| C25 | C26 | C27 | H34 | 120.3° | 120.3° |
| C25 | C26 | C27 | H35 | 120.4° | 120.4° |
| C26 | C25 | C24 | H30 | 69.4° | 69.4° |
| C26 | C25 | C24 | H31 | 171.3° | 171.3° |
| C26 | C25 | H32 | H33 | 118.5° | 118.5° |
| C25 | C26 | H34 | H35 | 118.9° | 118.9° |
| C25 | C26 | C27 | H37 | 64.7° | 64.7° |
| C25 | C26 | C27 | H36 | 175.9° | 175.9° |
| C18 | C17 | C16 | H21 | 120.3° | 120.3° |
| C18 | C17 | C16 | H20 | 120.3° | 120.3° |
| C18 | C17 | C16 | H18 | 178.5° | 178.5° |
| C18 | C17 | C16 | H19 | 61.7° | 61.7° |
| C18 | C17 | H21 | H20 | 119.2° | 119.2° |
| C17 | C18 | H23 | H22 | 119.7° | 119.7° |
| C17 | C18 | C19 | H25 | 172.5° | 172.5° |
| C17 | C18 | C19 | H24 | 68.2° | 68.2° |
| C17 | C16 | C15 | H17 | 168.0° | 168.0° |
| C17 | C16 | H18 | H19 | 119.7° | 119.7° |
| C16 | C17 | H21 | H20 | 119.2° | 119.2° |
| C16 | C17 | C18 | H23 | 59.0° | 59.0° |
| C16 | C17 | C18 | H22 | 178.9° | 178.9° |
| C26 | C27 | C22 | H27 | 63.9° | 63.9° |
| C27 | C26 | C25 | H32 | 173.4° | 173.4° |
| C27 | C26 | C25 | H33 | 67.6° | 67.6° |
| C27 | C26 | H34 | H35 | 118.9° | 118.9° |
| C26 | C27 | H37 | H36 | 119.1° | 119.1° |
| H12 | C11 | C10 | H11 | 171.9° | 171.9° |
| H12 | C11 | C12 | H13 | 166.5° | 166.5° |
| H12 | C11 | C12 | H14 | 74.5° | 74.5° |
| H7 | C7 | H8 | H6 | 120.0° | 120.0° |
| H9 | C9 | C10 | H11 | 41.3° | 41.3° |
| H10 | C9 | C10 | H11 | 160.6° | 160.6° |
| H13 | C12 | C13 | H15 | 104.6° | 104.6° |
| H13 | C12 | C13 | H16 | 135.3° | 135.2° |
| H14 | C12 | C13 | H15 | 14.4° | 14.4° |
| H14 | C12 | C13 | H16 | 105.7° | 105.7° |
| H2 | C1 | H3 | H1 | 120.0° | 120.0° |
| H17 | C15 | C16 | H18 | 71.8° | 71.8° |
| H17 | C15 | C16 | H19 | 48.0° | 48.0° |
| H18 | C16 | C17 | H21 | 61.2° | 61.2° |
| H18 | C16 | C17 | H20 | 58.2° | 58.2° |
| H19 | C16 | C17 | H21 | 58.6° | 58.6° |
| H19 | C16 | C17 | H20 | 178.0° | 178.0° |
| H21 | C17 | C18 | H23 | 61.2° | 61.2° |
| H21 | C17 | C18 | H22 | 58.6° | 58.6° |
| H20 | C17 | C18 | H23 | 179.3° | 179.3° |
| H20 | C17 | C18 | H22 | 60.9° | 60.9° |
| H23 | C18 | C19 | H25 | 52.4° | 52.5° |
| H23 | C18 | C19 | H24 | 171.8° | 171.8° |
| H22 | C18 | C19 | H25 | 67.4° | 67.4° |
| H22 | C18 | C19 | H24 | 51.9° | 51.9° |
| H26 | C21 | C22 | H27 | 165.3° | 165.3° |
| H27 | C22 | C23 | H29 | 174.8° | 174.8° |
| H27 | C22 | C23 | H28 | 56.2° | 56.2° |
| H27 | C22 | C27 | H37 | 175.9° | 175.9° |
| H27 | C22 | C27 | H36 | 56.4° | 56.4° |
| H29 | C23 | C24 | H30 | 170.9° | 170.9° |
| H29 | C23 | C24 | H31 | 51.6° | 51.6° |
| H28 | C23 | C24 | H30 | 52.2° | 52.2° |
| H28 | C23 | C24 | H31 | 67.1° | 67.0° |
| H30 | C24 | C25 | H32 | 51.1° | 51.1° |
| H30 | C24 | C25 | H33 | 170.1° | 170.1° |
| H31 | C24 | C25 | H32 | 68.2° | 68.2° |
| H31 | C24 | C25 | H33 | 50.8° | 50.8° |
| H32 | C25 | C26 | H34 | 53.1° | 53.1° |
| H32 | C25 | C26 | H35 | 66.2° | 66.2° |
| H33 | C25 | C26 | H34 | 172.1° | 172.1° |
| H33 | C25 | C26 | H35 | 52.8° | 52.8° |
| H34 | C26 | C27 | H37 | 175.0° | 175.0° |
| H34 | C26 | C27 | H36 | 55.6° | 55.6° |
| H35 | C26 | C27 | H37 | 55.7° | 55.7° |
| H35 | C26 | C27 | H36 | 63.7° | 63.7° |
