A1AD5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C20 | C8 | sing | 1.53Å | 1.52Å | |
| C22 | O3 | sing | 1.45Å | 1.44Å | |
| O2 | C21 | doub | 1.22Å | 1.21Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C21 | O3 | sing | 1.35Å | 1.35Å | |
| C21 | C15 | sing | 1.47Å | 1.48Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| C6 | N1 | sing | 1.47Å | 1.47Å | |
| C8 | C7 | sing | 1.55Å | 1.55Å | |
| C8 | C9 | sing | 1.55Å | 1.55Å | |
| C8 | O1 | sing | 1.44Å | 1.48Å | |
| C7 | C11 | sing | 1.54Å | 1.55Å | |
| C2 | N1 | sing | 1.47Å | 1.47Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C15 | C9 | sing | 1.51Å | 1.50Å | |
| C15 | C14 | doub | 1.35Å | 1.35Å | |
| C9 | C10 | sing | 1.55Å | 1.57Å | |
| O1 | C13 | sing | 1.42Å | 1.47Å | |
| C14 | C13 | sing | 1.52Å | 1.51Å | |
| C13 | C19 | sing | 1.52Å | 1.51Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | sing | 1.55Å | 1.55Å | |
| C10 | C12 | sing | 1.54Å | 1.56Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| C12 | C16 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.08Å | 1.08Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C5 | H28 | sing | 1.09Å | 1.10Å | |
| C5 | H29 | sing | 1.09Å | 1.10Å | |
| C6 | H30 | sing | 1.09Å | 1.10Å | |
| C7 | H31 | sing | 1.09Å | 1.10Å | |
| C9 | H32 | sing | 1.09Å | 1.10Å | |
| N1 | H33 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 111.0° | 109.2° |
| C4 | C5 | C6 | 111.1° | 109.3° |
| C5 | C4 | H1 | 109.1° | 109.5° |
| C5 | C4 | H2 | 109.1° | 109.6° |
| C4 | C5 | H28 | 109.0° | 109.5° |
| C4 | C5 | H29 | 109.1° | 109.5° |
| C4 | C3 | C2 | 111.2° | 109.3° |
| C3 | C4 | H1 | 109.1° | 109.5° |
| C3 | C4 | H2 | 109.1° | 109.5° |
| C4 | C3 | H3 | 109.0° | 109.5° |
| C4 | C3 | H4 | 109.0° | 109.5° |
| C20 | C8 | C7 | 113.3° | 112.7° |
| C20 | C8 | C9 | 117.7° | 112.7° |
| C20 | C8 | O1 | 107.0° | 113.0° |
| C8 | C20 | H22 | 109.5° | 109.4° |
| C8 | C20 | H23 | 109.5° | 109.5° |
| C8 | C20 | H24 | 109.5° | 109.5° |
| C22 | O3 | C21 | 115.6° | 117.0° |
| O3 | C22 | H25 | 109.5° | 109.4° |
| O3 | C22 | H26 | 109.5° | 109.5° |
| O3 | C22 | H27 | 109.5° | 109.5° |
| O2 | C21 | O3 | 122.9° | 120.0° |
| O2 | C21 | C15 | 124.8° | 120.0° |
| C5 | C6 | C7 | 109.8° | 109.5° |
| C5 | C6 | N1 | 107.8° | 109.5° |
| C6 | C5 | H28 | 109.1° | 109.5° |
| C6 | C5 | H29 | 109.1° | 109.5° |
| C5 | C6 | H30 | 108.0° | 109.4° |
| O3 | C21 | C15 | 112.3° | 120.0° |
| C21 | C15 | C9 | 119.4° | 122.9° |
| C21 | C15 | C14 | 124.0° | 122.9° |
| C3 | C2 | N1 | 109.1° | 109.5° |
| C3 | C2 | C1 | 112.4° | 109.5° |
| C2 | C3 | H3 | 109.0° | 109.5° |
| C2 | C3 | H4 | 109.1° | 109.5° |
| C3 | C2 | H5 | 108.4° | 109.5° |
| C7 | C6 | N1 | 114.2° | 109.5° |
| C6 | C7 | C8 | 117.7° | 110.2° |
| C6 | C7 | C11 | 119.2° | 110.1° |
| C7 | C6 | H30 | 108.0° | 109.5° |
| C6 | C7 | H31 | 105.4° | 110.2° |
| C6 | N1 | C2 | 112.5° | 111.2° |
| N1 | C6 | H30 | 108.9° | 109.5° |
| C6 | N1 | H33 | 108.7° | 111.0° |
| C7 | C8 | C9 | 96.3° | 102.6° |
| C7 | C8 | O1 | 114.5° | 106.7° |
| C8 | C7 | C11 | 102.5° | 106.0° |
| C8 | C7 | H31 | 105.3° | 110.2° |
| C9 | C8 | O1 | 108.2° | 108.5° |
| C8 | C9 | C15 | 107.6° | 109.8° |
| C8 | C9 | C10 | 97.5° | 101.0° |
| C8 | C9 | H32 | 112.5° | 111.4° |
| C8 | O1 | C13 | 116.2° | 114.2° |
| C7 | C11 | C10 | 103.8° | 105.7° |
| C7 | C11 | H10 | 110.9° | 110.2° |
| C7 | C11 | H11 | 110.9° | 110.2° |
| C11 | C7 | H31 | 105.3° | 110.1° |
| N1 | C2 | C1 | 109.3° | 109.4° |
| N1 | C2 | H5 | 109.1° | 109.5° |
| C2 | N1 | H33 | 108.7° | 111.0° |
| C1 | C2 | H5 | 108.5° | 109.4° |
| C2 | C1 | H6 | 109.5° | 109.4° |
| C2 | C1 | H7 | 109.5° | 109.5° |
| C2 | C1 | H8 | 109.5° | 109.5° |
| C9 | C15 | C14 | 114.1° | 114.2° |
| C15 | C9 | C10 | 112.7° | 110.6° |
| C15 | C9 | H32 | 113.3° | 111.3° |
| C15 | C14 | C13 | 115.8° | 111.4° |
| C15 | C14 | H13 | 122.1° | 124.3° |
| C9 | C10 | C11 | 103.7° | 102.3° |
| C9 | C10 | C12 | 110.8° | 108.0° |
| C9 | C10 | H9 | 110.8° | 113.8° |
| C10 | C9 | H32 | 112.2° | 112.2° |
| O1 | C13 | C14 | 106.9° | 108.2° |
| O1 | C13 | C19 | 111.7° | 112.3° |
| O1 | C13 | C12 | 105.1° | 109.4° |
| C14 | C13 | C19 | 114.8° | 109.7° |
| C14 | C13 | C12 | 106.8° | 107.5° |
| C13 | C14 | H13 | 122.1° | 124.3° |
| C19 | C13 | C12 | 110.9° | 109.7° |
| C13 | C19 | C18 | 108.6° | 109.1° |
| C13 | C19 | H20 | 109.7° | 109.5° |
| C13 | C19 | H21 | 109.7° | 109.5° |
| C13 | C12 | C10 | 107.6° | 109.2° |
| C13 | C12 | C16 | 110.4° | 109.0° |
| C13 | C12 | H12 | 107.0° | 109.3° |
| C11 | C10 | C12 | 109.1° | 106.0° |
| C11 | C10 | H9 | 111.2° | 113.1° |
| C10 | C11 | H10 | 110.9° | 110.2° |
| C10 | C11 | H11 | 110.9° | 110.2° |
| C10 | C12 | C16 | 117.6° | 110.5° |
| C12 | C10 | H9 | 111.0° | 112.9° |
| C10 | C12 | H12 | 106.8° | 109.4° |
| C19 | C18 | C17 | 112.2° | 109.9° |
| C19 | C18 | H18 | 108.8° | 109.4° |
| C19 | C18 | H19 | 108.8° | 109.3° |
| C18 | C19 | H20 | 109.7° | 109.6° |
| C18 | C19 | H21 | 109.7° | 109.6° |
| C12 | C16 | C17 | 110.3° | 108.9° |
| C16 | C12 | H12 | 107.0° | 109.5° |
| C12 | C16 | H14 | 109.3° | 109.6° |
| C12 | C16 | H15 | 109.2° | 109.5° |
| C18 | C17 | C16 | 112.2° | 109.9° |
| C18 | C17 | H16 | 108.8° | 109.4° |
| C18 | C17 | H17 | 108.8° | 109.3° |
| C17 | C18 | H18 | 108.8° | 109.4° |
| C17 | C18 | H19 | 108.8° | 109.4° |
| C17 | C16 | H14 | 109.2° | 109.6° |
| C17 | C16 | H15 | 109.3° | 109.6° |
| C16 | C17 | H16 | 108.8° | 109.4° |
| C16 | C17 | H17 | 108.8° | 109.4° |
| H1 | C4 | H2 | 109.4° | 109.6° |
| H3 | C3 | H4 | 109.5° | 109.6° |
| H6 | C1 | H7 | 109.5° | 109.5° |
| H6 | C1 | H8 | 109.4° | 109.5° |
| H7 | C1 | H8 | 109.5° | 109.5° |
| H10 | C11 | H11 | 109.5° | 110.2° |
| H14 | C16 | H15 | 109.4° | 109.7° |
| H16 | C17 | H17 | 109.5° | 109.4° |
| H18 | C18 | H19 | 109.4° | 109.4° |
| H20 | C19 | H21 | 109.5° | 109.6° |
| H22 | C20 | H23 | 109.4° | 109.4° |
| H22 | C20 | H24 | 109.5° | 109.5° |
| H23 | C20 | H24 | 109.5° | 109.4° |
| H25 | C22 | H26 | 109.5° | 109.4° |
| H25 | C22 | H27 | 109.5° | 109.5° |
| H26 | C22 | H27 | 109.5° | 109.5° |
| H28 | C5 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | H1 | 120.3° | 119.9° |
| C5 | C4 | C3 | H2 | 120.2° | 119.9° |
| C4 | C5 | C6 | H28 | 120.2° | 120.0° |
| C4 | C5 | C6 | H29 | 120.3° | 119.9° |
| C5 | C4 | C3 | C2 | 51.6° | 57.6° |
| C4 | C5 | C6 | C7 | 177.9° | 179.2° |
| C4 | C5 | C6 | N1 | 57.2° | 59.2° |
| C5 | C4 | H1 | H2 | 119.3° | 120.2° |
| C5 | C4 | C3 | H3 | 68.6° | 62.3° |
| C5 | C4 | C3 | H4 | 171.9° | 177.6° |
| C4 | C5 | H28 | H29 | 119.3° | 120.1° |
| C4 | C5 | C6 | H30 | 60.3° | 60.8° |
| C3 | C4 | C5 | C6 | 52.7° | 57.6° |
| C4 | C3 | C2 | H3 | 120.2° | 119.9° |
| C4 | C3 | C2 | H4 | 120.3° | 120.0° |
| C4 | C3 | C2 | N1 | 55.4° | 59.2° |
| C4 | C3 | C2 | C1 | 176.9° | 179.2° |
| C3 | C4 | H1 | H2 | 119.3° | 120.1° |
| C4 | C3 | H3 | H4 | 119.2° | 120.1° |
| C4 | C3 | C2 | H5 | 63.3° | 60.8° |
| C3 | C4 | C5 | H28 | 173.0° | 177.6° |
| C3 | C4 | C5 | H29 | 67.5° | 62.3° |
| C20 | C8 | C7 | C6 | 51.3° | 92.7° |
| C20 | C8 | C7 | C9 | 123.8° | 121.4° |
| C20 | C8 | C7 | O1 | 123.0° | 124.6° |
| C20 | C8 | C9 | O1 | 121.2° | 125.9° |
| C20 | C8 | C7 | C11 | 175.7° | 148.2° |
| C20 | C8 | C9 | C15 | 65.0° | 77.2° |
| C20 | C8 | C9 | C10 | 178.2° | 166.0° |
| C20 | C8 | O1 | C13 | 123.6° | 132.9° |
| C8 | C20 | H22 | H23 | 120.0° | 120.0° |
| C8 | C20 | H22 | H24 | 120.0° | 120.0° |
| C8 | C20 | H23 | H24 | 120.0° | 120.0° |
| C20 | C8 | C7 | H31 | 65.8° | 29.1° |
| C20 | C8 | C9 | H32 | 60.4° | 46.6° |
| C22 | O3 | C21 | O2 | 5.9° | 0.1° |
| C22 | O3 | C21 | C15 | 174.0° | 180.0° |
| O3 | C22 | H25 | H26 | 120.0° | 120.0° |
| O3 | C22 | H25 | H27 | 120.0° | 120.0° |
| O3 | C22 | H26 | H27 | 120.0° | 120.0° |
| O2 | C21 | O3 | C15 | 179.9° | 179.9° |
| O2 | C21 | C15 | C9 | 2.4° | 179.9° |
| O2 | C21 | C15 | C14 | 158.4° | 0.0° |
| C5 | C6 | C7 | N1 | 121.2° | 120.0° |
| C5 | C6 | C7 | H30 | 117.6° | 119.9° |
| C5 | C6 | N1 | H30 | 117.0° | 120.0° |
| C5 | C6 | C7 | C8 | 117.4° | 60.5° |
| C5 | C6 | C7 | C11 | 117.5° | 177.1° |
| C5 | C6 | N1 | C2 | 63.4° | 61.7° |
| C6 | C5 | C4 | H1 | 173.0° | 62.3° |
| C6 | C5 | C4 | H2 | 67.5° | 177.6° |
| C6 | C5 | H28 | H29 | 119.3° | 120.1° |
| C5 | C6 | C7 | H31 | 0.4° | 61.3° |
| C5 | C6 | N1 | H33 | 176.1° | 174.2° |
| O3 | C21 | C15 | C9 | 177.5° | 0.0° |
| O3 | C21 | C15 | C14 | 21.7° | 180.0° |
| C21 | O3 | C22 | H25 | 180.0° | 180.0° |
| C21 | O3 | C22 | H26 | 60.0° | 60.0° |
| C21 | O3 | C22 | H27 | 60.0° | 60.0° |
| C21 | C15 | C9 | C8 | 108.2° | 127.2° |
| C21 | C15 | C9 | C14 | 162.7° | 180.0° |
| C21 | C15 | C9 | C10 | 145.5° | 122.2° |
| C21 | C15 | C14 | C13 | 163.6° | 179.4° |
| C21 | C15 | C14 | H13 | 16.4° | 0.5° |
| C21 | C15 | C9 | H32 | 16.8° | 3.3° |
| C3 | C2 | N1 | C6 | 63.0° | 61.8° |
| C3 | C2 | N1 | C1 | 123.3° | 120.0° |
| C3 | C2 | N1 | H5 | 118.2° | 120.1° |
| C3 | C2 | C1 | H5 | 119.8° | 120.0° |
| C2 | C3 | C4 | H1 | 171.9° | 62.3° |
| C2 | C3 | C4 | H2 | 68.6° | 177.6° |
| C2 | C3 | H3 | H4 | 119.2° | 120.1° |
| C3 | C2 | C1 | H6 | 180.0° | 55.1° |
| C3 | C2 | C1 | H7 | 60.0° | 175.1° |
| C3 | C2 | C1 | H8 | 60.0° | 64.9° |
| C3 | C2 | N1 | H33 | 176.6° | 174.2° |
| C7 | C6 | N1 | H30 | 120.7° | 120.0° |
| C6 | C7 | C8 | C11 | 133.0° | 119.1° |
| C6 | C7 | C8 | H31 | 117.1° | 121.8° |
| C6 | C7 | C8 | C9 | 175.1° | 145.9° |
| C6 | C7 | C8 | O1 | 71.7° | 32.0° |
| C6 | C7 | C11 | H31 | 118.0° | 121.7° |
| C7 | C6 | N1 | C2 | 174.3° | 178.3° |
| C6 | C7 | C11 | C10 | 157.0° | 117.9° |
| C6 | C7 | C11 | H10 | 83.9° | 1.2° |
| C6 | C7 | C11 | H11 | 37.9° | 123.0° |
| C7 | C6 | C5 | H28 | 57.7° | 60.8° |
| C7 | C6 | C5 | H29 | 61.9° | 59.3° |
| C7 | C6 | N1 | H33 | 53.8° | 54.2° |
| N1 | C6 | C7 | C8 | 121.4° | 179.5° |
| N1 | C6 | C7 | C11 | 3.7° | 62.9° |
| C6 | N1 | C2 | H33 | 120.4° | 124.1° |
| C6 | N1 | C2 | C1 | 173.7° | 178.2° |
| C6 | N1 | C2 | H5 | 55.2° | 58.3° |
| N1 | C6 | C5 | H28 | 177.4° | 179.1° |
| N1 | C6 | C5 | H29 | 63.1° | 60.8° |
| N1 | C6 | C7 | H31 | 121.6° | 58.7° |
| C7 | C8 | C9 | O1 | 118.3° | 112.6° |
| C8 | C7 | C11 | H31 | 110.0° | 119.2° |
| C7 | C8 | C9 | C15 | 174.6° | 161.4° |
| C7 | C8 | C9 | C10 | 57.8° | 44.5° |
| C7 | C8 | O1 | C13 | 110.1° | 102.7° |
| C8 | C7 | C11 | C10 | 24.9° | 1.3° |
| C8 | C7 | C11 | H10 | 144.0° | 120.4° |
| C8 | C7 | C11 | H11 | 94.2° | 117.9° |
| C7 | C8 | C20 | H22 | 180.0° | 60.0° |
| C7 | C8 | C20 | H23 | 60.0° | 180.0° |
| C7 | C8 | C20 | H24 | 60.0° | 60.0° |
| C8 | C7 | C6 | H30 | 0.1° | 59.5° |
| C7 | C8 | C9 | H32 | 60.0° | 74.8° |
| C9 | C8 | C7 | C11 | 51.9° | 26.8° |
| C8 | C9 | C15 | C10 | 106.3° | 110.6° |
| C8 | C9 | C15 | H32 | 125.0° | 123.9° |
| C8 | C9 | C15 | C14 | 54.5° | 52.8° |
| C8 | C9 | C10 | H32 | 118.0° | 118.8° |
| C9 | C8 | O1 | C13 | 4.1° | 7.2° |
| C8 | C9 | C10 | C11 | 43.5° | 45.3° |
| C8 | C9 | C10 | C12 | 73.4° | 66.2° |
| C8 | C9 | C10 | H9 | 162.9° | 167.6° |
| C9 | C8 | C20 | H22 | 68.9° | 55.5° |
| C9 | C8 | C20 | H23 | 171.1° | 64.5° |
| C9 | C8 | C20 | H24 | 51.1° | 175.5° |
| C9 | C8 | C7 | H31 | 58.0° | 92.3° |
| O1 | C8 | C7 | C11 | 61.3° | 87.2° |
| O1 | C8 | C9 | C15 | 56.2° | 48.8° |
| O1 | C8 | C9 | C10 | 60.5° | 68.1° |
| C8 | O1 | C13 | C14 | 49.1° | 61.1° |
| C8 | O1 | C13 | C19 | 175.5° | 177.7° |
| C8 | O1 | C13 | C12 | 64.1° | 55.7° |
| O1 | C8 | C20 | H22 | 53.0° | 178.9° |
| O1 | C8 | C20 | H23 | 67.0° | 58.9° |
| O1 | C8 | C20 | H24 | 173.0° | 61.1° |
| O1 | C8 | C7 | H31 | 171.2° | 153.7° |
| O1 | C8 | C9 | H32 | 178.3° | 172.6° |
| C7 | C11 | C10 | C9 | 11.6° | 28.9° |
| C7 | C11 | C10 | H10 | 119.1° | 119.1° |
| C7 | C11 | C10 | H11 | 119.1° | 119.1° |
| C7 | C11 | C10 | C12 | 106.5° | 84.2° |
| C7 | C11 | C10 | H9 | 130.8° | 151.7° |
| C7 | C11 | H10 | H11 | 122.7° | 121.8° |
| C11 | C7 | C6 | H30 | 124.9° | 57.1° |
| N1 | C2 | C1 | H5 | 118.9° | 119.9° |
| N1 | C2 | C3 | H3 | 64.8° | 60.7° |
| N1 | C2 | C3 | H4 | 175.7° | 179.1° |
| N1 | C2 | C1 | H6 | 58.7° | 175.2° |
| N1 | C2 | C1 | H7 | 61.3° | 64.9° |
| N1 | C2 | C1 | H8 | 178.7° | 55.2° |
| C2 | N1 | C6 | H30 | 53.6° | 58.2° |
| C1 | C2 | C3 | H3 | 56.6° | 59.2° |
| C1 | C2 | C3 | H4 | 62.9° | 60.9° |
| C2 | C1 | H6 | H7 | 120.0° | 120.0° |
| C2 | C1 | H6 | H8 | 120.0° | 120.0° |
| C2 | C1 | H7 | H8 | 120.0° | 120.0° |
| C1 | C2 | N1 | H33 | 53.3° | 54.1° |
| C15 | C9 | C10 | H32 | 129.3° | 125.0° |
| C9 | C15 | C14 | C13 | 1.8° | 0.5° |
| C15 | C9 | C10 | C11 | 156.2° | 161.5° |
| C15 | C9 | C10 | C12 | 39.2° | 50.0° |
| C15 | C9 | C10 | H9 | 84.5° | 76.2° |
| C9 | C15 | C14 | H13 | 178.2° | 179.5° |
| C14 | C15 | C9 | C10 | 51.8° | 57.8° |
| C15 | C14 | C13 | O1 | 54.4° | 58.0° |
| C15 | C14 | C13 | H13 | 180.0° | 180.0° |
| C15 | C14 | C13 | C19 | 178.8° | 179.2° |
| C15 | C14 | C13 | C12 | 57.8° | 60.0° |
| C14 | C15 | C9 | H32 | 179.5° | 176.7° |
| C9 | C10 | C12 | C13 | 17.4° | 8.1° |
| C9 | C10 | C11 | C12 | 118.1° | 113.0° |
| C9 | C10 | C11 | H9 | 119.1° | 122.8° |
| C9 | C10 | C12 | H9 | 123.6° | 126.7° |
| C9 | C10 | C12 | C16 | 107.9° | 111.7° |
| C9 | C10 | C11 | H10 | 107.5° | 147.9° |
| C9 | C10 | C11 | H11 | 130.7° | 90.2° |
| C9 | C10 | C12 | H12 | 131.9° | 127.7° |
| O1 | C13 | C14 | C19 | 124.5° | 122.8° |
| O1 | C13 | C14 | C12 | 112.1° | 118.0° |
| O1 | C13 | C19 | C12 | 116.9° | 121.9° |
| O1 | C13 | C12 | C10 | 48.7° | 54.1° |
| O1 | C13 | C19 | C18 | 176.8° | 177.9° |
| O1 | C13 | C12 | C16 | 178.2° | 174.9° |
| O1 | C13 | C12 | H12 | 65.7° | 65.5° |
| O1 | C13 | C14 | H13 | 125.7° | 122.0° |
| O1 | C13 | C19 | H20 | 56.9° | 62.2° |
| O1 | C13 | C19 | H21 | 63.3° | 57.9° |
| C14 | C13 | C19 | C12 | 121.2° | 117.8° |
| C14 | C13 | C12 | C10 | 64.7° | 63.1° |
| C14 | C13 | C19 | C18 | 61.3° | 57.6° |
| C14 | C13 | C12 | C16 | 64.8° | 57.7° |
| C14 | C13 | C12 | H12 | 179.0° | 177.2° |
| C14 | C13 | C19 | H20 | 178.9° | 177.5° |
| C14 | C13 | C19 | H21 | 58.6° | 62.4° |
| C19 | C13 | C12 | C10 | 169.6° | 177.7° |
| C13 | C19 | C18 | H20 | 119.8° | 119.9° |
| C13 | C19 | C18 | H21 | 119.9° | 119.9° |
| C19 | C13 | C12 | C16 | 60.9° | 61.5° |
| C13 | C19 | C18 | C17 | 56.4° | 59.0° |
| C19 | C13 | C12 | H12 | 55.2° | 58.0° |
| C19 | C13 | C14 | H13 | 1.2° | 0.8° |
| C13 | C19 | C18 | H18 | 176.8° | 61.2° |
| C13 | C19 | C18 | H19 | 64.0° | 179.1° |
| C13 | C19 | H20 | H21 | 120.4° | 120.1° |
| C13 | C12 | C10 | C11 | 96.2° | 100.9° |
| C13 | C12 | C10 | C16 | 125.3° | 119.9° |
| C13 | C12 | C10 | H12 | 114.5° | 119.6° |
| C12 | C13 | C19 | C18 | 59.9° | 60.3° |
| C13 | C12 | C16 | H12 | 116.1° | 119.5° |
| C13 | C12 | C16 | C17 | 55.7° | 60.7° |
| C13 | C12 | C10 | H9 | 141.0° | 134.8° |
| C12 | C13 | C14 | H13 | 122.2° | 120.0° |
| C13 | C12 | C16 | H14 | 64.5° | 59.2° |
| C13 | C12 | C16 | H15 | 175.8° | 179.5° |
| C12 | C13 | C19 | H20 | 60.0° | 59.6° |
| C12 | C13 | C19 | H21 | 179.8° | 179.8° |
| C11 | C10 | C12 | H9 | 122.9° | 124.3° |
| C11 | C10 | C12 | C16 | 138.6° | 139.2° |
| C10 | C11 | H10 | H11 | 122.6° | 121.9° |
| C11 | C10 | C12 | H12 | 18.4° | 18.7° |
| C10 | C11 | C7 | H31 | 85.0° | 120.5° |
| C11 | C10 | C9 | H32 | 74.5° | 73.5° |
| C10 | C12 | C16 | H12 | 120.1° | 120.6° |
| C10 | C12 | C16 | C17 | 179.5° | 179.4° |
| C12 | C10 | C11 | H10 | 134.4° | 34.9° |
| C12 | C10 | C11 | H11 | 12.6° | 156.7° |
| C10 | C12 | C16 | H14 | 59.4° | 60.8° |
| C10 | C12 | C16 | H15 | 60.3° | 59.5° |
| C12 | C10 | C9 | H32 | 168.5° | 175.0° |
| C19 | C18 | C17 | H18 | 120.4° | 120.2° |
| C19 | C18 | C17 | H19 | 120.4° | 120.0° |
| C19 | C18 | C17 | C16 | 53.7° | 59.1° |
| C19 | C18 | C17 | H16 | 66.7° | 179.2° |
| C19 | C18 | C17 | H17 | 174.0° | 61.0° |
| C19 | C18 | H18 | H19 | 118.8° | 119.7° |
| C18 | C19 | H20 | H21 | 120.4° | 120.3° |
| C12 | C16 | C17 | C18 | 52.6° | 59.8° |
| C12 | C16 | C17 | H14 | 120.2° | 119.8° |
| C12 | C16 | C17 | H15 | 120.1° | 119.8° |
| C16 | C12 | C10 | H9 | 15.7° | 14.9° |
| C12 | C16 | H14 | H15 | 119.6° | 120.2° |
| C12 | C16 | C17 | H16 | 67.8° | 180.0° |
| C12 | C16 | C17 | H17 | 173.0° | 60.2° |
| C18 | C17 | C16 | H16 | 120.4° | 120.1° |
| C18 | C17 | C16 | H17 | 120.4° | 120.0° |
| C18 | C17 | C16 | H14 | 67.6° | 60.0° |
| C18 | C17 | C16 | H15 | 172.7° | 179.6° |
| C18 | C17 | H16 | H17 | 118.8° | 119.7° |
| C17 | C18 | H18 | H19 | 118.7° | 119.8° |
| C17 | C18 | C19 | H20 | 63.4° | 60.9° |
| C17 | C18 | C19 | H21 | 176.3° | 178.8° |
| C17 | C16 | C12 | H12 | 60.4° | 58.8° |
| C17 | C16 | H14 | H15 | 119.6° | 120.3° |
| C16 | C17 | H16 | H17 | 118.7° | 119.8° |
| C16 | C17 | C18 | H18 | 174.1° | 61.1° |
| C16 | C17 | C18 | H19 | 66.8° | 179.1° |
| H1 | C4 | C3 | H3 | 51.6° | 177.8° |
| H1 | C4 | C3 | H4 | 67.8° | 57.7° |
| H1 | C4 | C5 | H28 | 66.8° | 57.7° |
| H1 | C4 | C5 | H29 | 52.8° | 177.8° |
| H2 | C4 | C3 | H3 | 171.1° | 57.7° |
| H2 | C4 | C3 | H4 | 51.7° | 62.5° |
| H2 | C4 | C5 | H28 | 52.7° | 62.5° |
| H2 | C4 | C5 | H29 | 172.3° | 57.6° |
| H3 | C3 | C2 | H5 | 176.5° | 179.2° |
| H4 | C3 | C2 | H5 | 57.0° | 59.1° |
| H5 | C2 | C1 | H6 | 60.2° | 64.9° |
| H5 | C2 | C1 | H7 | 179.8° | 55.0° |
| H5 | C2 | C1 | H8 | 59.8° | 175.1° |
| H5 | C2 | N1 | H33 | 65.2° | 65.8° |
| H6 | C1 | H7 | H8 | 119.9° | 120.1° |
| H9 | C10 | C11 | H10 | 11.7° | 89.3° |
| H9 | C10 | C11 | H11 | 110.2° | 32.5° |
| H9 | C10 | C12 | H12 | 104.5° | 105.7° |
| H9 | C10 | C9 | H32 | 44.8° | 48.8° |
| H10 | C11 | C7 | H31 | 34.0° | 120.5° |
| H11 | C11 | C7 | H31 | 155.9° | 1.3° |
| H12 | C12 | C16 | H14 | 179.5° | 178.7° |
| H12 | C12 | C16 | H15 | 59.8° | 61.0° |
| H14 | C16 | C17 | H16 | 172.0° | 60.1° |
| H14 | C16 | C17 | H17 | 52.8° | 179.9° |
| H15 | C16 | C17 | H16 | 52.3° | 60.3° |
| H15 | C16 | C17 | H17 | 66.9° | 59.6° |
| H16 | C17 | C18 | H18 | 53.7° | 59.0° |
| H16 | C17 | C18 | H19 | 172.8° | 60.7° |
| H17 | C17 | C18 | H18 | 65.5° | 178.8° |
| H17 | C17 | C18 | H19 | 53.6° | 59.0° |
| H18 | C18 | C19 | H20 | 57.0° | 178.9° |
| H18 | C18 | C19 | H21 | 63.3° | 58.7° |
| H19 | C18 | C19 | H20 | 176.2° | 59.2° |
| H19 | C18 | C19 | H21 | 55.9° | 61.1° |
| H22 | C20 | H23 | H24 | 119.9° | 120.0° |
| H25 | C22 | H26 | H27 | 120.0° | 120.0° |
| H28 | C5 | C6 | H30 | 59.9° | 59.1° |
| H29 | C5 | C6 | H30 | 179.4° | 179.2° |
| H30 | C6 | C7 | H31 | 117.2° | 178.7° |
| H30 | C6 | N1 | H33 | 66.9° | 65.8° |
