X1K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C17 | doub | 1.21Å | 1.23Å | |
| C17 | N | sing | 1.34Å | 1.37Å | |
| C17 | C16 | sing | 1.51Å | 1.51Å | |
| N | C18 | sing | 1.34Å | 1.37Å | |
| C16 | C15 | sing | 1.54Å | 1.53Å | |
| C18 | O1 | doub | 1.21Å | 1.23Å | |
| C18 | C15 | sing | 1.51Å | 1.52Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| O3 | C14 | sing | 1.43Å | 1.43Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C6 | sing | 1.53Å | 1.54Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.54Å | 1.56Å | |
| C6 | C7 | sing | 1.51Å | 1.52Å | |
| C3 | C2 | sing | 1.52Å | 1.53Å | |
| C5 | C19 | sing | 1.53Å | 1.54Å | |
| C5 | C10 | sing | 1.52Å | 1.59Å | |
| C12 | C7 | doub | 1.31Å | 1.32Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C7 | C8 | sing | 1.51Å | 1.52Å | |
| C10 | C1 | sing | 1.52Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.53Å | |
| C1 | C20 | sing | 1.55Å | 1.53Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C8 | C9 | sing | 1.54Å | 1.52Å | |
| C8 | O | sing | 1.43Å | 1.44Å | |
| N | H1 | sing | 0.97Å | 1.00Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| O | H5 | sing | 0.97Å | 0.95Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.12Å | 1.10Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.10Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C4 | H25 | sing | 1.09Å | 1.10Å | |
| C4 | H26 | sing | 1.09Å | 1.10Å | |
| C6 | H27 | sing | 1.09Å | 1.10Å | |
| C8 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.08Å | 1.10Å | |
| C9 | H30 | sing | 1.09Å | 1.10Å | |
| O3 | H31 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C17 | N | 124.9° | 125.5° |
| O2 | C17 | C16 | 126.7° | 125.4° |
| N | C17 | C16 | 108.4° | 109.2° |
| C17 | N | C18 | 114.0° | 114.5° |
| C17 | N | H1 | 123.0° | 122.8° |
| C17 | C16 | C15 | 104.8° | 103.6° |
| C17 | C16 | H15 | 110.6° | 110.6° |
| C17 | C16 | H16 | 110.6° | 110.8° |
| N | C18 | O1 | 124.7° | 125.4° |
| N | C18 | C15 | 108.1° | 109.2° |
| C18 | N | H1 | 123.0° | 122.7° |
| C16 | C15 | C18 | 104.4° | 103.5° |
| C16 | C15 | C14 | 115.0° | 110.6° |
| C16 | C15 | H14 | 109.5° | 110.6° |
| C15 | C16 | H15 | 110.6° | 110.6° |
| C15 | C16 | H16 | 110.6° | 110.6° |
| O1 | C18 | C15 | 127.2° | 125.4° |
| C18 | C15 | C14 | 108.6° | 110.9° |
| C18 | C15 | H14 | 109.6° | 110.4° |
| C15 | C14 | O3 | 107.9° | 109.5° |
| C15 | C14 | C13 | 114.2° | 109.4° |
| C15 | C14 | H13 | 108.3° | 109.5° |
| C14 | C15 | H14 | 109.5° | 110.6° |
| O3 | C14 | C13 | 108.3° | 109.5° |
| O3 | C14 | H13 | 109.7° | 109.5° |
| C14 | O3 | H31 | 109.5° | 114.0° |
| C14 | C13 | C6 | 118.1° | 109.4° |
| C14 | C13 | H11 | 107.3° | 109.5° |
| C14 | C13 | H12 | 107.3° | 109.4° |
| C13 | C14 | H13 | 108.4° | 109.5° |
| C13 | C6 | C5 | 113.0° | 109.7° |
| C13 | C6 | C7 | 113.2° | 109.1° |
| C6 | C13 | H11 | 107.3° | 109.5° |
| C6 | C13 | H12 | 107.2° | 109.5° |
| C13 | C6 | H27 | 106.3° | 110.0° |
| C3 | C4 | C5 | 114.0° | 110.1° |
| C4 | C3 | C2 | 111.7° | 109.5° |
| C4 | C3 | H23 | 108.9° | 108.6° |
| C4 | C3 | H24 | 108.9° | 110.8° |
| C3 | C4 | H25 | 108.3° | 109.3° |
| C3 | C4 | H26 | 108.3° | 108.7° |
| C4 | C5 | C6 | 111.2° | 108.0° |
| C4 | C5 | C19 | 107.6° | 109.6° |
| C4 | C5 | C10 | 107.9° | 110.5° |
| C5 | C4 | H25 | 108.4° | 109.4° |
| C5 | C4 | H26 | 108.3° | 110.1° |
| C5 | C6 | C7 | 110.9° | 108.8° |
| C6 | C5 | C19 | 108.7° | 107.9° |
| C6 | C5 | C10 | 109.1° | 107.9° |
| C5 | C6 | H27 | 106.2° | 109.4° |
| C6 | C7 | C12 | 123.2° | 120.5° |
| C6 | C7 | C8 | 114.1° | 118.9° |
| C7 | C6 | H27 | 106.6° | 109.9° |
| C3 | C2 | C1 | 113.4° | 111.2° |
| C3 | C2 | H6 | 108.5° | 109.6° |
| C3 | C2 | H7 | 108.5° | 109.5° |
| C2 | C3 | H23 | 108.9° | 108.9° |
| C2 | C3 | H24 | 108.9° | 110.7° |
| C19 | C5 | C10 | 112.4° | 112.7° |
| C5 | C19 | H17 | 109.5° | 109.5° |
| C5 | C19 | H18 | 109.5° | 109.5° |
| C5 | C19 | H19 | 109.4° | 109.4° |
| C5 | C10 | C1 | 110.8° | 115.6° |
| C5 | C10 | C9 | 109.2° | 110.9° |
| C5 | C10 | H8 | 107.8° | 105.9° |
| C12 | C7 | C8 | 121.3° | 120.5° |
| C7 | C12 | H9 | 120.0° | 120.0° |
| C7 | C12 | H10 | 120.0° | 120.0° |
| C2 | C1 | C10 | 112.4° | 112.2° |
| C2 | C1 | C20 | 100.8° | 106.6° |
| C2 | C1 | C | 115.6° | 109.7° |
| C1 | C2 | H6 | 108.5° | 109.1° |
| C1 | C2 | H7 | 108.5° | 109.0° |
| C7 | C8 | C9 | 113.7° | 108.6° |
| C7 | C8 | O | 115.7° | 109.9° |
| C7 | C8 | H28 | 106.2° | 109.8° |
| C1 | C10 | C9 | 111.7° | 111.6° |
| C10 | C1 | C20 | 100.0° | 108.4° |
| C10 | C1 | C | 121.6° | 112.4° |
| C1 | C10 | H8 | 108.7° | 106.4° |
| C10 | C9 | C8 | 112.4° | 108.8° |
| C9 | C10 | H8 | 108.5° | 105.8° |
| C10 | C9 | H29 | 108.7° | 111.8° |
| C10 | C9 | H30 | 108.7° | 110.2° |
| C20 | C1 | C | 101.7° | 107.3° |
| C1 | C20 | H20 | 109.5° | 109.5° |
| C1 | C20 | H21 | 109.5° | 109.5° |
| C1 | C20 | H22 | 109.5° | 109.5° |
| C1 | C | H2 | 109.5° | 109.5° |
| C1 | C | H3 | 109.5° | 109.5° |
| C1 | C | H4 | 109.5° | 109.5° |
| C9 | C8 | O | 107.3° | 109.6° |
| C9 | C8 | H28 | 106.2° | 109.3° |
| C8 | C9 | H29 | 108.7° | 109.4° |
| C8 | C9 | H30 | 108.7° | 107.9° |
| C8 | O | H5 | 109.5° | 114.0° |
| O | C8 | H28 | 107.2° | 109.7° |
| H2 | C | H3 | 109.5° | 109.5° |
| H2 | C | H4 | 109.5° | 109.5° |
| H3 | C | H4 | 109.5° | 109.4° |
| H6 | C2 | H7 | 109.5° | 108.4° |
| H9 | C12 | H10 | 120.0° | 120.0° |
| H11 | C13 | H12 | 109.5° | 109.5° |
| H15 | C16 | H16 | 109.5° | 110.5° |
| H17 | C19 | H18 | 109.5° | 109.5° |
| H17 | C19 | H19 | 109.5° | 109.4° |
| H18 | C19 | H19 | 109.5° | 109.5° |
| H20 | C20 | H21 | 109.5° | 109.5° |
| H20 | C20 | H22 | 109.5° | 109.4° |
| H21 | C20 | H22 | 109.4° | 109.5° |
| H23 | C3 | H24 | 109.5° | 108.2° |
| H25 | C4 | H26 | 109.5° | 109.2° |
| H29 | C9 | H30 | 109.5° | 108.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C17 | N | C16 | 177.5° | 180.0° |
| O2 | C17 | N | C18 | 174.5° | 180.0° |
| O2 | C17 | C16 | C15 | 171.8° | 179.7° |
| O2 | C17 | N | H1 | 5.5° | 0.3° |
| O2 | C17 | C16 | H15 | 68.9° | 61.8° |
| O2 | C17 | C16 | H16 | 52.5° | 61.1° |
| C17 | N | C18 | H1 | 180.0° | 179.7° |
| N | C17 | C16 | C15 | 5.7° | 0.2° |
| C17 | N | C18 | O1 | 179.9° | 179.8° |
| C17 | N | C18 | C15 | 1.0° | 0.3° |
| N | C17 | C16 | H15 | 113.6° | 118.3° |
| N | C17 | C16 | H16 | 125.0° | 118.9° |
| C16 | C17 | N | C18 | 3.1° | 0.0° |
| C17 | C16 | C15 | H15 | 119.3° | 118.5° |
| C17 | C16 | C15 | H16 | 119.3° | 118.7° |
| C17 | C16 | C15 | C18 | 6.0° | 0.4° |
| C17 | C16 | C15 | C14 | 125.0° | 118.5° |
| C16 | C17 | N | H1 | 176.9° | 179.8° |
| C17 | C16 | C15 | H14 | 111.3° | 118.6° |
| C17 | C16 | H15 | H16 | 122.2° | 123.0° |
| N | C18 | C15 | C16 | 4.5° | 0.4° |
| N | C18 | O1 | C15 | 179.0° | 179.9° |
| N | C18 | C15 | C14 | 127.7° | 118.2° |
| N | C18 | C15 | H14 | 112.7° | 118.8° |
| C16 | C15 | C18 | O1 | 176.4° | 179.6° |
| C16 | C15 | C18 | C14 | 123.2° | 118.6° |
| C16 | C15 | C18 | H14 | 117.2° | 118.4° |
| C16 | C15 | C14 | H14 | 123.8° | 122.9° |
| C16 | C15 | C14 | O3 | 47.6° | 62.2° |
| C16 | C15 | C14 | C13 | 72.8° | 177.8° |
| C16 | C15 | C14 | H13 | 166.3° | 57.9° |
| C15 | C16 | H15 | H16 | 122.2° | 122.8° |
| O1 | C18 | C15 | C14 | 53.2° | 61.7° |
| O1 | C18 | N | H1 | 0.1° | 0.0° |
| O1 | C18 | C15 | H14 | 66.4° | 61.2° |
| C18 | C15 | C14 | H14 | 119.7° | 122.9° |
| C18 | C15 | C14 | O3 | 68.9° | 176.5° |
| C18 | C15 | C14 | C13 | 170.7° | 63.6° |
| C15 | C18 | N | H1 | 179.0° | 180.0° |
| C18 | C15 | C14 | H13 | 49.8° | 56.4° |
| C18 | C15 | C16 | H15 | 113.2° | 118.1° |
| C18 | C15 | C16 | H16 | 125.3° | 119.1° |
| C15 | C14 | O3 | C13 | 124.1° | 119.9° |
| C15 | C14 | O3 | H13 | 117.8° | 120.0° |
| C15 | C14 | C13 | H13 | 120.8° | 120.0° |
| C15 | C14 | C13 | C6 | 71.1° | 178.4° |
| C15 | C14 | C13 | H11 | 167.6° | 61.6° |
| C15 | C14 | C13 | H12 | 50.1° | 58.4° |
| C14 | C15 | C16 | H15 | 5.7° | 123.0° |
| C14 | C15 | C16 | H16 | 115.8° | 0.2° |
| C15 | C14 | O3 | H31 | 180.0° | 64.9° |
| O3 | C14 | C13 | H13 | 118.9° | 120.0° |
| O3 | C14 | C13 | C6 | 168.7° | 61.6° |
| O3 | C14 | C13 | H11 | 47.4° | 58.4° |
| O3 | C14 | C13 | H12 | 70.1° | 178.4° |
| O3 | C14 | C15 | H14 | 171.4° | 60.7° |
| C14 | C13 | C6 | H11 | 121.3° | 120.0° |
| C14 | C13 | C6 | H12 | 121.2° | 119.9° |
| C14 | C13 | C6 | C5 | 149.7° | 87.6° |
| C14 | C13 | C6 | C7 | 83.2° | 153.4° |
| C14 | C13 | H11 | H12 | 116.1° | 120.0° |
| C13 | C14 | C15 | H14 | 51.0° | 59.3° |
| C14 | C13 | C6 | H27 | 33.6° | 32.8° |
| C13 | C14 | O3 | H31 | 55.9° | 55.0° |
| C13 | C6 | C5 | C4 | 55.6° | 66.7° |
| C13 | C6 | C5 | C7 | 128.4° | 119.2° |
| C13 | C6 | C5 | H27 | 116.2° | 120.7° |
| C13 | C6 | C7 | H27 | 116.6° | 120.7° |
| C13 | C6 | C5 | C19 | 62.6° | 51.7° |
| C13 | C6 | C5 | C10 | 174.5° | 173.8° |
| C13 | C6 | C7 | C12 | 12.3° | 9.8° |
| C13 | C6 | C7 | C8 | 179.4° | 170.5° |
| C6 | C13 | H11 | H12 | 116.1° | 120.0° |
| C6 | C13 | C14 | H13 | 49.7° | 58.4° |
| C3 | C4 | C5 | H25 | 120.7° | 120.2° |
| C3 | C4 | C5 | H26 | 120.7° | 119.8° |
| C3 | C4 | C5 | C6 | 175.4° | 174.0° |
| C4 | C3 | C2 | H23 | 120.3° | 118.7° |
| C4 | C3 | C2 | H24 | 120.3° | 122.5° |
| C3 | C4 | C5 | C19 | 65.7° | 68.7° |
| C3 | C4 | C5 | C10 | 55.8° | 56.1° |
| C4 | C3 | C2 | C1 | 49.8° | 59.3° |
| C4 | C3 | C2 | H6 | 170.4° | 61.4° |
| C4 | C3 | C2 | H7 | 70.8° | 179.9° |
| C4 | C3 | H23 | H24 | 119.0° | 120.4° |
| C3 | C4 | H25 | H26 | 117.9° | 118.8° |
| C4 | C5 | C6 | C19 | 118.2° | 118.4° |
| C4 | C5 | C6 | C10 | 118.9° | 119.5° |
| C4 | C5 | C6 | C7 | 176.0° | 174.1° |
| C5 | C4 | C3 | C2 | 53.2° | 62.2° |
| C4 | C5 | C19 | C10 | 118.6° | 123.5° |
| C4 | C5 | C10 | C1 | 56.4° | 49.0° |
| C4 | C5 | C10 | C9 | 179.9° | 177.3° |
| C4 | C5 | C10 | H8 | 62.4° | 68.5° |
| C4 | C5 | C19 | H17 | 180.0° | 67.5° |
| C4 | C5 | C19 | H18 | 60.0° | 172.5° |
| C4 | C5 | C19 | H19 | 60.0° | 52.5° |
| C5 | C4 | C3 | H23 | 67.1° | 178.9° |
| C5 | C4 | C3 | H24 | 173.5° | 60.2° |
| C5 | C4 | H25 | H26 | 117.9° | 120.5° |
| C4 | C5 | C6 | H27 | 60.6° | 54.0° |
| C5 | C6 | C7 | H27 | 115.1° | 119.7° |
| C6 | C5 | C19 | C10 | 120.9° | 119.1° |
| C5 | C6 | C7 | C12 | 140.5° | 129.4° |
| C5 | C6 | C7 | C8 | 52.4° | 50.9° |
| C6 | C5 | C10 | C1 | 177.3° | 166.9° |
| C6 | C5 | C10 | C9 | 59.2° | 64.8° |
| C6 | C5 | C10 | H8 | 58.5° | 49.4° |
| C5 | C6 | C13 | H11 | 89.1° | 152.4° |
| C5 | C6 | C13 | H12 | 28.5° | 32.4° |
| C6 | C5 | C19 | H17 | 59.5° | 175.2° |
| C6 | C5 | C19 | H18 | 60.5° | 55.1° |
| C6 | C5 | C19 | H19 | 179.5° | 64.9° |
| C6 | C5 | C4 | H25 | 54.7° | 53.8° |
| C6 | C5 | C4 | H26 | 64.0° | 66.3° |
| C7 | C6 | C5 | C19 | 65.7° | 67.5° |
| C7 | C6 | C5 | C10 | 57.1° | 54.5° |
| C6 | C7 | C12 | C8 | 166.2° | 179.7° |
| C6 | C7 | C8 | C9 | 48.9° | 50.2° |
| C6 | C7 | C8 | O | 173.7° | 170.0° |
| C6 | C7 | C12 | H9 | 166.2° | 7.8° |
| C6 | C7 | C12 | H10 | 13.8° | 172.3° |
| C7 | C6 | C13 | H11 | 38.1° | 33.4° |
| C7 | C6 | C13 | H12 | 155.6° | 86.7° |
| C6 | C7 | C8 | H28 | 67.5° | 69.3° |
| C3 | C2 | C1 | H6 | 120.6° | 121.0° |
| C3 | C2 | C1 | H7 | 120.6° | 120.8° |
| C3 | C2 | C1 | C10 | 52.7° | 50.8° |
| C3 | C2 | C1 | C20 | 158.3° | 169.3° |
| C3 | C2 | C1 | C | 93.1° | 74.9° |
| C3 | C2 | H6 | H7 | 118.2° | 119.4° |
| C2 | C3 | H23 | H24 | 119.0° | 120.4° |
| C2 | C3 | C4 | H25 | 67.5° | 58.0° |
| C2 | C3 | C4 | H26 | 173.9° | 177.2° |
| C19 | C5 | C10 | C1 | 62.0° | 74.0° |
| C19 | C5 | C10 | C9 | 61.5° | 54.3° |
| C19 | C5 | C10 | H8 | 179.2° | 168.5° |
| C5 | C19 | H17 | H18 | 120.0° | 120.1° |
| C5 | C19 | H17 | H19 | 120.0° | 119.9° |
| C5 | C19 | H18 | H19 | 120.0° | 120.0° |
| C19 | C5 | C4 | H25 | 173.6° | 171.1° |
| C19 | C5 | C4 | H26 | 55.0° | 51.1° |
| C19 | C5 | C6 | H27 | 178.8° | 172.4° |
| C5 | C10 | C1 | C2 | 55.9° | 46.5° |
| C5 | C10 | C1 | C9 | 122.1° | 127.9° |
| C5 | C10 | C1 | H8 | 118.3° | 117.2° |
| C5 | C10 | C9 | H8 | 117.2° | 114.3° |
| C5 | C10 | C1 | C20 | 162.1° | 163.8° |
| C5 | C10 | C1 | C | 87.4° | 77.8° |
| C5 | C10 | C9 | C8 | 56.1° | 64.6° |
| C10 | C5 | C19 | H17 | 61.4° | 56.1° |
| C10 | C5 | C19 | H18 | 178.6° | 64.0° |
| C10 | C5 | C19 | H19 | 58.6° | 176.0° |
| C10 | C5 | C4 | H25 | 64.9° | 64.1° |
| C10 | C5 | C4 | H26 | 176.4° | 175.9° |
| C10 | C5 | C6 | H27 | 58.3° | 65.5° |
| C5 | C10 | C9 | H29 | 64.3° | 56.3° |
| C5 | C10 | C9 | H30 | 176.6° | 177.2° |
| C12 | C7 | C8 | C9 | 143.7° | 130.1° |
| C12 | C7 | C8 | O | 18.9° | 10.3° |
| C7 | C12 | H9 | H10 | 180.0° | 180.0° |
| C12 | C7 | C6 | H27 | 104.3° | 110.9° |
| C12 | C7 | C8 | H28 | 99.8° | 110.4° |
| C2 | C1 | C10 | C20 | 106.2° | 117.4° |
| C2 | C1 | C10 | C | 143.4° | 124.2° |
| C2 | C1 | C10 | C9 | 178.0° | 174.4° |
| C2 | C1 | C20 | C | 119.2° | 117.5° |
| C2 | C1 | C | H2 | 180.0° | 59.3° |
| C2 | C1 | C | H3 | 60.0° | 179.4° |
| C2 | C1 | C | H4 | 60.0° | 60.7° |
| C1 | C2 | H6 | H7 | 118.3° | 118.6° |
| C2 | C1 | C10 | H8 | 62.3° | 70.7° |
| C2 | C1 | C20 | H20 | 180.0° | 60.0° |
| C2 | C1 | C20 | H21 | 60.0° | 180.0° |
| C2 | C1 | C20 | H22 | 60.0° | 60.0° |
| C1 | C2 | C3 | H23 | 70.5° | 178.0° |
| C1 | C2 | C3 | H24 | 170.1° | 63.1° |
| C7 | C8 | C9 | C10 | 51.1° | 53.4° |
| C7 | C8 | C9 | O | 129.3° | 120.0° |
| C7 | C8 | C9 | H28 | 116.4° | 119.7° |
| C7 | C8 | O | H28 | 118.2° | 120.7° |
| C7 | C8 | O | H5 | 180.0° | 60.0° |
| C8 | C7 | C12 | H9 | 0.0° | 172.5° |
| C8 | C7 | C12 | H10 | 180.0° | 7.4° |
| C8 | C7 | C6 | H27 | 62.8° | 68.8° |
| C7 | C8 | C9 | H29 | 69.4° | 69.0° |
| C7 | C8 | C9 | H30 | 171.5° | 173.0° |
| C1 | C10 | C9 | H8 | 119.8° | 115.3° |
| C10 | C1 | C20 | C | 125.4° | 121.6° |
| C1 | C10 | C9 | C8 | 179.1° | 165.0° |
| C10 | C1 | C | H2 | 37.7° | 175.1° |
| C10 | C1 | C | H3 | 82.3° | 55.0° |
| C10 | C1 | C | H4 | 157.7° | 64.9° |
| C10 | C1 | C2 | H6 | 173.2° | 70.2° |
| C10 | C1 | C2 | H7 | 67.9° | 171.6° |
| C10 | C1 | C20 | H20 | 64.7° | 60.9° |
| C10 | C1 | C20 | H21 | 175.3° | 59.1° |
| C10 | C1 | C20 | H22 | 55.4° | 179.1° |
| C1 | C10 | C9 | H29 | 58.6° | 74.1° |
| C1 | C10 | C9 | H30 | 60.4° | 46.8° |
| C9 | C10 | C1 | C20 | 75.8° | 68.2° |
| C9 | C10 | C1 | C | 34.6° | 50.1° |
| C10 | C9 | C8 | H29 | 120.4° | 122.4° |
| C10 | C9 | C8 | H30 | 120.4° | 119.6° |
| C10 | C9 | C8 | O | 179.7° | 173.5° |
| C10 | C9 | C8 | H28 | 65.4° | 66.3° |
| C10 | C9 | H29 | H30 | 118.6° | 121.9° |
| C20 | C1 | C | H2 | 71.9° | 56.1° |
| C20 | C1 | C | H3 | 168.1° | 64.0° |
| C20 | C1 | C | H4 | 48.2° | 176.1° |
| C20 | C1 | C2 | H6 | 81.2° | 48.3° |
| C20 | C1 | C2 | H7 | 37.7° | 69.9° |
| C20 | C1 | C10 | H8 | 43.9° | 46.7° |
| C1 | C20 | H20 | H21 | 120.0° | 120.0° |
| C1 | C20 | H20 | H22 | 120.0° | 120.0° |
| C1 | C20 | H21 | H22 | 120.0° | 120.0° |
| C1 | C | H2 | H3 | 120.0° | 120.0° |
| C1 | C | H2 | H4 | 120.0° | 120.0° |
| C1 | C | H3 | H4 | 120.0° | 120.0° |
| C | C1 | C2 | H6 | 27.5° | 164.1° |
| C | C1 | C2 | H7 | 146.4° | 45.9° |
| C | C1 | C10 | H8 | 154.3° | 165.0° |
| C | C1 | C20 | H20 | 60.8° | 177.5° |
| C | C1 | C20 | H21 | 59.2° | 62.5° |
| C | C1 | C20 | H22 | 179.2° | 57.5° |
| C9 | C8 | O | H28 | 113.7° | 120.0° |
| C9 | C8 | O | H5 | 51.9° | 179.3° |
| C8 | C9 | C10 | H8 | 61.1° | 49.7° |
| C8 | C9 | H29 | H30 | 118.7° | 117.5° |
| O | C8 | C9 | H29 | 59.9° | 51.0° |
| O | C8 | C9 | H30 | 59.3° | 66.9° |
| H2 | C | H3 | H4 | 120.0° | 120.0° |
| H5 | O | C8 | H28 | 61.8° | 60.7° |
| H6 | C2 | C3 | H23 | 50.0° | 57.2° |
| H6 | C2 | C3 | H24 | 69.3° | 176.1° |
| H7 | C2 | C3 | H23 | 168.9° | 61.5° |
| H7 | C2 | C3 | H24 | 49.5° | 57.4° |
| H8 | C10 | C9 | H29 | 178.4° | 170.6° |
| H8 | C10 | C9 | H30 | 59.3° | 68.5° |
| H11 | C13 | C14 | H13 | 71.5° | 178.4° |
| H11 | C13 | C6 | H27 | 154.8° | 87.2° |
| H12 | C13 | C14 | H13 | 170.9° | 61.6° |
| H12 | C13 | C6 | H27 | 87.6° | 152.7° |
| H13 | C14 | C15 | H14 | 69.9° | 179.3° |
| H13 | C14 | O3 | H31 | 62.2° | 175.1° |
| H14 | C15 | C16 | H15 | 129.5° | 0.1° |
| H14 | C15 | C16 | H16 | 8.0° | 122.6° |
| H17 | C19 | H18 | H19 | 120.0° | 120.0° |
| H20 | C20 | H21 | H22 | 120.0° | 120.0° |
| H23 | C3 | C4 | H25 | 172.2° | 60.8° |
| H23 | C3 | C4 | H26 | 53.5° | 58.3° |
| H24 | C3 | C4 | H25 | 52.9° | 179.6° |
| H24 | C3 | C4 | H26 | 65.8° | 60.4° |
| H28 | C8 | C9 | H29 | 174.2° | 171.2° |
| H28 | C8 | C9 | H30 | 55.1° | 53.3° |
