OTK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.54Å | 1.53Å | |
| C1 | C5 | sing | 1.52Å | 1.54Å | |
| C1 | C10 | sing | 1.52Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C3 | O3 | sing | 1.45Å | 1.43Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| O3 | C21 | sing | 1.35Å | 1.37Å | |
| C4 | C5 | sing | 1.54Å | 1.53Å | |
| C4 | C26 | sing | 1.53Å | 1.53Å | |
| O4 | C21 | doub | 1.22Å | 1.22Å | |
| C5 | C6 | sing | 1.52Å | 1.53Å | |
| O5 | C6 | sing | 1.45Å | 1.44Å | |
| O5 | C12 | sing | 1.34Å | 1.36Å | |
| C6 | C7 | sing | 1.51Å | 1.53Å | |
| O6 | C7 | sing | 1.43Å | 1.43Å | |
| C7 | C8 | sing | 1.51Å | 1.54Å | |
| C7 | C11 | sing | 1.53Å | 1.54Å | |
| O7 | C8 | sing | 1.45Å | 1.44Å | |
| O7 | C27 | sing | 1.34Å | 1.36Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| O8 | C27 | doub | 1.21Å | 1.23Å | |
| C9 | C10 | sing | 1.57Å | 1.54Å | |
| O9 | C10 | sing | 1.45Å | 1.43Å | |
| O9 | C32 | sing | 1.34Å | 1.36Å | |
| C10 | C31 | sing | 1.53Å | 1.53Å | |
| O10 | C32 | doub | 1.21Å | 1.23Å | |
| C11 | O11 | sing | 1.43Å | 1.43Å | |
| C11 | C12 | sing | 1.51Å | 1.53Å | |
| C11 | C34 | sing | 1.53Å | 1.53Å | |
| C12 | O12 | doub | 1.21Å | 1.23Å | |
| C21 | C22 | sing | 1.47Å | 1.52Å | |
| C22 | C23 | sing | 1.51Å | 1.52Å | |
| C22 | C24 | doub | 1.33Å | 1.42Å | |
| C24 | C25 | sing | 1.51Å | 1.51Å | |
| C27 | C28 | sing | 1.51Å | 1.53Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C29 | C30 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | sing | 1.51Å | 1.53Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| O11 | HO11 | sing | 0.97Å | 0.95Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C23 | H23B | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C26 | H26B | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C30 | H30B | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C31 | H31B | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C33 | H33B | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C34 | H34B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C5 | 100.0° | 102.1° |
| C2 | C1 | C10 | 114.1° | 109.5° |
| C1 | C2 | C3 | 105.7° | 102.7° |
| C2 | C1 | H1 | 117.5° | 109.0° |
| C1 | C2 | H2 | 110.7° | 110.7° |
| C1 | C2 | H2A | 110.7° | 110.8° |
| C5 | C1 | C10 | 120.5° | 118.0° |
| C1 | C5 | C4 | 103.0° | 103.7° |
| C1 | C5 | C6 | 117.6° | 113.0° |
| C5 | C1 | H1 | 110.6° | 109.1° |
| C1 | C5 | H5 | 109.7° | 109.9° |
| C1 | C10 | C9 | 113.2° | 113.0° |
| C1 | C10 | O9 | 103.7° | 108.7° |
| C1 | C10 | C31 | 112.4° | 108.7° |
| C10 | C1 | H1 | 95.3° | 108.8° |
| C2 | C3 | O3 | 113.0° | 110.1° |
| C2 | C3 | C4 | 106.2° | 106.2° |
| C3 | C2 | H2 | 110.8° | 110.7° |
| C3 | C2 | H2A | 110.8° | 110.8° |
| C2 | C3 | H3 | 108.6° | 110.2° |
| O3 | C3 | C4 | 107.5° | 110.1° |
| C3 | O3 | C21 | 111.7° | 117.0° |
| O3 | C3 | H3 | 107.5° | 110.1° |
| C3 | C4 | C5 | 103.4° | 105.6° |
| C3 | C4 | C26 | 110.6° | 110.2° |
| C4 | C3 | H3 | 114.1° | 110.0° |
| C3 | C4 | H4 | 113.3° | 110.2° |
| O3 | C21 | O4 | 119.1° | 119.9° |
| O3 | C21 | C22 | 120.9° | 120.0° |
| C5 | C4 | C26 | 111.2° | 110.3° |
| C4 | C5 | C6 | 112.8° | 109.7° |
| C5 | C4 | H4 | 112.7° | 110.2° |
| C4 | C5 | H5 | 114.9° | 110.0° |
| C26 | C4 | H4 | 105.8° | 110.3° |
| C4 | C26 | H26 | 109.5° | 109.5° |
| C4 | C26 | H26A | 109.4° | 109.5° |
| C4 | C26 | H26B | 109.5° | 109.4° |
| O4 | C21 | C22 | 120.0° | 120.1° |
| C5 | C6 | O5 | 112.5° | 114.0° |
| C5 | C6 | C7 | 114.3° | 111.9° |
| C6 | C5 | H5 | 99.3° | 110.3° |
| C5 | C6 | H6 | 102.7° | 108.6° |
| C6 | O5 | C12 | 104.7° | 108.1° |
| O5 | C6 | C7 | 105.6° | 105.9° |
| O5 | C6 | H6 | 112.0° | 108.5° |
| O5 | C12 | C11 | 110.5° | 107.7° |
| O5 | C12 | O12 | 124.4° | 126.2° |
| C6 | C7 | O6 | 110.3° | 109.3° |
| C6 | C7 | C8 | 106.5° | 111.6° |
| C6 | C7 | C11 | 104.7° | 103.6° |
| C7 | C6 | H6 | 110.0° | 107.8° |
| O6 | C7 | C8 | 110.0° | 109.5° |
| O6 | C7 | C11 | 108.9° | 109.3° |
| C7 | O6 | HO6 | 109.5° | 114.0° |
| C8 | C7 | C11 | 116.2° | 113.4° |
| C7 | C8 | O7 | 112.0° | 108.5° |
| C7 | C8 | C9 | 111.2° | 114.2° |
| C7 | C8 | H8 | 106.7° | 108.5° |
| C7 | C11 | O11 | 111.6° | 110.4° |
| C7 | C11 | C12 | 101.0° | 104.3° |
| C7 | C11 | C34 | 112.2° | 110.5° |
| C8 | O7 | C27 | 115.1° | 117.0° |
| O7 | C8 | C9 | 109.8° | 108.5° |
| O7 | C8 | H8 | 108.1° | 108.5° |
| O7 | C27 | O8 | 120.6° | 120.0° |
| O7 | C27 | C28 | 118.7° | 120.0° |
| C8 | C9 | C10 | 117.0° | 108.6° |
| C9 | C8 | H8 | 109.0° | 108.5° |
| C8 | C9 | H9 | 107.0° | 109.5° |
| C8 | C9 | H9A | 107.1° | 109.4° |
| O8 | C27 | C28 | 120.7° | 120.0° |
| C9 | C10 | O9 | 106.8° | 108.8° |
| C9 | C10 | C31 | 111.2° | 108.9° |
| C10 | C9 | H9 | 107.0° | 109.9° |
| C10 | C9 | H9A | 107.0° | 109.8° |
| C10 | O9 | C32 | 118.2° | 117.0° |
| O9 | C10 | C31 | 109.1° | 108.6° |
| O9 | C32 | O10 | 120.6° | 120.0° |
| O9 | C32 | C33 | 119.0° | 120.0° |
| C10 | C31 | H31 | 109.5° | 109.5° |
| C10 | C31 | H31A | 109.5° | 109.5° |
| C10 | C31 | H31B | 109.4° | 109.4° |
| O10 | C32 | C33 | 120.4° | 120.0° |
| O11 | C11 | C12 | 111.5° | 110.5° |
| O11 | C11 | C34 | 109.7° | 110.4° |
| C11 | O11 | HO11 | 109.5° | 114.0° |
| C12 | C11 | C34 | 110.7° | 110.5° |
| C11 | C12 | O12 | 125.0° | 126.2° |
| C11 | C34 | H34 | 109.5° | 109.5° |
| C11 | C34 | H34A | 109.5° | 109.5° |
| C11 | C34 | H34B | 109.5° | 109.5° |
| C21 | C22 | C23 | 118.9° | 120.0° |
| C21 | C22 | C24 | 122.4° | 120.0° |
| C23 | C22 | C24 | 118.7° | 120.0° |
| C22 | C23 | H23 | 109.5° | 109.5° |
| C22 | C23 | H23A | 109.5° | 109.4° |
| C22 | C23 | H23B | 109.5° | 109.5° |
| C22 | C24 | C25 | 122.7° | 120.0° |
| C22 | C24 | H24 | 118.6° | 120.0° |
| C25 | C24 | H24 | 118.7° | 120.0° |
| C24 | C25 | H25 | 109.5° | 109.4° |
| C24 | C25 | H25A | 109.5° | 109.5° |
| C24 | C25 | H25B | 109.5° | 109.5° |
| C27 | C28 | C29 | 112.3° | 109.5° |
| C27 | C28 | H28 | 108.5° | 109.5° |
| C27 | C28 | H28A | 108.5° | 109.5° |
| C28 | C29 | C30 | 111.4° | 109.5° |
| C29 | C28 | H28 | 108.5° | 109.5° |
| C29 | C28 | H28A | 108.5° | 109.5° |
| C28 | C29 | H29 | 108.8° | 109.4° |
| C28 | C29 | H29A | 108.8° | 109.5° |
| C30 | C29 | H29 | 108.8° | 109.4° |
| C30 | C29 | H29A | 108.8° | 109.5° |
| C29 | C30 | H30 | 109.5° | 109.5° |
| C29 | C30 | H30A | 109.4° | 109.4° |
| C29 | C30 | H30B | 109.4° | 109.5° |
| C32 | C33 | H33 | 109.5° | 109.5° |
| C32 | C33 | H33A | 109.5° | 109.5° |
| C32 | C33 | H33B | 109.4° | 109.5° |
| H2 | C2 | H2A | 108.1° | 110.8° |
| H9 | C9 | H9A | 111.8° | 109.6° |
| H23 | C23 | H23A | 109.5° | 109.5° |
| H23 | C23 | H23B | 109.5° | 109.5° |
| H23A | C23 | H23B | 109.5° | 109.5° |
| H25 | C25 | H25A | 109.4° | 109.4° |
| H25 | C25 | H25B | 109.5° | 109.5° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| H26 | C26 | H26A | 109.5° | 109.5° |
| H26 | C26 | H26B | 109.4° | 109.5° |
| H26A | C26 | H26B | 109.5° | 109.4° |
| H28 | C28 | H28A | 110.4° | 109.4° |
| H29 | C29 | H29A | 110.1° | 109.5° |
| H30 | C30 | H30A | 109.5° | 109.5° |
| H30 | C30 | H30B | 109.5° | 109.4° |
| H30A | C30 | H30B | 109.5° | 109.4° |
| H31 | C31 | H31A | 109.4° | 109.5° |
| H31 | C31 | H31B | 109.5° | 109.5° |
| H31A | C31 | H31B | 109.5° | 109.5° |
| H33 | C33 | H33A | 109.5° | 109.4° |
| H33 | C33 | H33B | 109.5° | 109.5° |
| H33A | C33 | H33B | 109.5° | 109.5° |
| H34 | C34 | H34A | 109.4° | 109.4° |
| H34 | C34 | H34B | 109.4° | 109.5° |
| H34A | C34 | H34B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C5 | C10 | 125.7° | 120.0° |
| C2 | C1 | C5 | H1 | 124.6° | 115.2° |
| C2 | C1 | C10 | H1 | 123.4° | 119.0° |
| C1 | C2 | C3 | H2 | 120.0° | 118.3° |
| C1 | C2 | C3 | H2A | 120.0° | 118.4° |
| C1 | C2 | C3 | O3 | 104.6° | 147.4° |
| C1 | C2 | C3 | C4 | 13.0° | 28.2° |
| C2 | C1 | C5 | C4 | 46.4° | 41.5° |
| C2 | C1 | C5 | C6 | 171.2° | 77.2° |
| C2 | C1 | C10 | C9 | 165.2° | 48.0° |
| C2 | C1 | C10 | O9 | 49.8° | 168.9° |
| C2 | C1 | C10 | C31 | 67.9° | 73.0° |
| C1 | C2 | H2 | H2A | 121.5° | 123.4° |
| C1 | C2 | C3 | H3 | 136.2° | 90.9° |
| C2 | C1 | C5 | H5 | 76.4° | 159.1° |
| C5 | C1 | C10 | H1 | 117.7° | 124.9° |
| C5 | C1 | C2 | C3 | 36.2° | 43.1° |
| C1 | C5 | C4 | C3 | 39.1° | 24.1° |
| C1 | C5 | C4 | C6 | 127.8° | 121.0° |
| C1 | C5 | C4 | H5 | 119.3° | 117.5° |
| C1 | C5 | C4 | C26 | 157.8° | 95.0° |
| C1 | C5 | C6 | H5 | 118.2° | 123.5° |
| C1 | C5 | C6 | O5 | 149.8° | 171.3° |
| C1 | C5 | C6 | C7 | 29.4° | 68.7° |
| C5 | C1 | C10 | C9 | 75.9° | 68.0° |
| C5 | C1 | C10 | O9 | 168.7° | 52.8° |
| C5 | C1 | C10 | C31 | 51.0° | 170.9° |
| C5 | C1 | C2 | H2 | 83.8° | 161.4° |
| C5 | C1 | C2 | H2A | 156.3° | 75.2° |
| C1 | C5 | C4 | H4 | 83.6° | 143.0° |
| C1 | C5 | C6 | H6 | 89.7° | 50.1° |
| C10 | C1 | C2 | C3 | 93.8° | 168.9° |
| C10 | C1 | C5 | C4 | 79.3° | 161.5° |
| C10 | C1 | C5 | C6 | 45.4° | 42.8° |
| C1 | C10 | C9 | C8 | 62.6° | 92.7° |
| C1 | C10 | C9 | O9 | 113.5° | 120.8° |
| C1 | C10 | C9 | C31 | 127.5° | 120.9° |
| C1 | C10 | O9 | C31 | 119.9° | 118.1° |
| C1 | C10 | O9 | C32 | 178.7° | 180.0° |
| C10 | C1 | C2 | H2 | 146.2° | 72.8° |
| C10 | C1 | C2 | H2A | 26.3° | 50.5° |
| C10 | C1 | C5 | H5 | 157.9° | 80.9° |
| C1 | C10 | C9 | H9 | 57.4° | 147.5° |
| C1 | C10 | C9 | H9A | 177.4° | 26.9° |
| C1 | C10 | C31 | H31 | 180.0° | 60.0° |
| C1 | C10 | C31 | H31A | 60.0° | 180.0° |
| C1 | C10 | C31 | H31B | 60.0° | 60.0° |
| C2 | C3 | O3 | C4 | 116.9° | 116.8° |
| C2 | C3 | O3 | H3 | 119.9° | 121.7° |
| C2 | C3 | C4 | H3 | 119.7° | 119.2° |
| C2 | C3 | O3 | C21 | 106.5° | 91.5° |
| C2 | C3 | C4 | C5 | 16.0° | 2.8° |
| C2 | C3 | C4 | C26 | 135.1° | 121.9° |
| C3 | C2 | C1 | H1 | 155.9° | 72.2° |
| C3 | C2 | H2 | H2A | 121.5° | 123.4° |
| C2 | C3 | C4 | H4 | 106.3° | 116.2° |
| O3 | C3 | C4 | H3 | 119.1° | 121.5° |
| O3 | C3 | C4 | C5 | 137.2° | 122.0° |
| O3 | C3 | C4 | C26 | 103.6° | 118.9° |
| C3 | O3 | C21 | O4 | 2.0° | 0.0° |
| C3 | O3 | C21 | C22 | 178.3° | 180.0° |
| O3 | C3 | C2 | H2 | 135.4° | 94.3° |
| O3 | C3 | C2 | H2A | 15.4° | 29.1° |
| O3 | C3 | C4 | H4 | 14.9° | 3.0° |
| C4 | C3 | O3 | C21 | 136.6° | 151.7° |
| C3 | C4 | C5 | C26 | 118.8° | 119.1° |
| C3 | C4 | C5 | H4 | 122.7° | 119.0° |
| C3 | C4 | C26 | H4 | 123.0° | 121.8° |
| C3 | C4 | C5 | C6 | 166.9° | 96.9° |
| C4 | C3 | C2 | H2 | 107.0° | 146.5° |
| C4 | C3 | C2 | H2A | 133.0° | 90.2° |
| C3 | C4 | C5 | H5 | 80.3° | 141.6° |
| C3 | C4 | C26 | H26 | 180.0° | 61.5° |
| C3 | C4 | C26 | H26A | 60.0° | 178.6° |
| C3 | C4 | C26 | H26B | 60.0° | 58.6° |
| O3 | C21 | O4 | C22 | 179.6° | 179.9° |
| O3 | C21 | C22 | C23 | 154.4° | 0.0° |
| O3 | C21 | C22 | C24 | 25.6° | 180.0° |
| C21 | O3 | C3 | H3 | 13.4° | 30.2° |
| C5 | C4 | C26 | H4 | 122.6° | 121.9° |
| C4 | C5 | C6 | H5 | 122.1° | 121.3° |
| C4 | C5 | C6 | O5 | 90.5° | 56.1° |
| C4 | C5 | C6 | C7 | 149.1° | 176.2° |
| C4 | C5 | C1 | H1 | 171.0° | 73.7° |
| C5 | C4 | C3 | H3 | 103.7° | 116.5° |
| C4 | C5 | C6 | H6 | 30.0° | 65.0° |
| C5 | C4 | C26 | H26 | 65.7° | 177.7° |
| C5 | C4 | C26 | H26A | 54.4° | 62.3° |
| C5 | C4 | C26 | H26B | 174.3° | 57.6° |
| C26 | C4 | C5 | C6 | 74.3° | 144.0° |
| C26 | C4 | C3 | H3 | 15.5° | 2.6° |
| C26 | C4 | C5 | H5 | 38.5° | 22.5° |
| C4 | C26 | H26 | H26A | 120.0° | 120.0° |
| C4 | C26 | H26 | H26B | 120.0° | 120.0° |
| C4 | C26 | H26A | H26B | 120.0° | 119.9° |
| O4 | C21 | C22 | C23 | 25.2° | 180.0° |
| O4 | C21 | C22 | C24 | 154.8° | 0.0° |
| C5 | C6 | O5 | C7 | 125.3° | 123.4° |
| C5 | C6 | O5 | H6 | 115.0° | 121.2° |
| C5 | C6 | O5 | C12 | 162.1° | 153.8° |
| C5 | C6 | C7 | H6 | 114.9° | 119.3° |
| C5 | C6 | C7 | O6 | 31.0° | 22.5° |
| C5 | C6 | C7 | C8 | 88.3° | 98.7° |
| C5 | C6 | C7 | C11 | 148.0° | 139.0° |
| C6 | C5 | C1 | H1 | 64.3° | 167.6° |
| C6 | C5 | C4 | H4 | 44.2° | 22.0° |
| O5 | C6 | C7 | H6 | 120.9° | 116.0° |
| O5 | C6 | C7 | O6 | 93.1° | 102.3° |
| O5 | C6 | C7 | C8 | 147.5° | 136.5° |
| O5 | C6 | C7 | C11 | 23.9° | 14.2° |
| C6 | O5 | C12 | C11 | 36.0° | 33.6° |
| C6 | O5 | C12 | O12 | 139.9° | 146.4° |
| O5 | C6 | C5 | H5 | 31.6° | 65.2° |
| C12 | O5 | C6 | C7 | 36.8° | 30.4° |
| O5 | C12 | C11 | C7 | 19.8° | 23.3° |
| O5 | C12 | C11 | O11 | 138.4° | 142.0° |
| O5 | C12 | C11 | O12 | 175.9° | 180.0° |
| O5 | C12 | C11 | C34 | 99.2° | 95.5° |
| C12 | O5 | C6 | H6 | 82.9° | 85.1° |
| C6 | C7 | O6 | C8 | 117.2° | 122.5° |
| C6 | C7 | O6 | C11 | 114.3° | 112.8° |
| C6 | C7 | C8 | C11 | 116.1° | 116.5° |
| C6 | C7 | C8 | O7 | 34.3° | 78.2° |
| C6 | C7 | C8 | C9 | 89.0° | 43.0° |
| C6 | C7 | C11 | O11 | 115.3° | 123.0° |
| C6 | C7 | C11 | C12 | 3.3° | 4.3° |
| C6 | C7 | C11 | C34 | 121.2° | 114.5° |
| C7 | C6 | C5 | H5 | 88.8° | 54.9° |
| C6 | C7 | O6 | HO6 | 180.0° | 180.0° |
| C6 | C7 | C8 | H8 | 152.3° | 164.2° |
| O6 | C7 | C8 | C11 | 124.4° | 122.3° |
| O6 | C7 | C8 | O7 | 153.8° | 160.7° |
| O6 | C7 | C8 | C9 | 30.5° | 78.1° |
| O6 | C7 | C11 | O11 | 126.8° | 120.5° |
| O6 | C7 | C11 | C12 | 114.6° | 120.8° |
| O6 | C7 | C11 | C34 | 3.3° | 2.0° |
| O6 | C7 | C6 | H6 | 145.9° | 141.8° |
| O6 | C7 | C8 | H8 | 88.2° | 43.0° |
| C7 | C8 | O7 | C9 | 124.1° | 124.7° |
| C7 | C8 | O7 | H8 | 117.2° | 117.7° |
| C7 | C8 | O7 | C27 | 92.4° | 150.0° |
| C7 | C8 | C9 | H8 | 117.3° | 121.2° |
| C7 | C8 | C9 | C10 | 65.5° | 41.4° |
| C8 | C7 | C11 | O11 | 1.9° | 1.9° |
| C8 | C7 | C11 | C12 | 120.5° | 116.8° |
| C8 | C7 | C11 | C34 | 121.7° | 124.4° |
| C8 | C7 | C6 | H6 | 26.6° | 20.5° |
| C8 | C7 | O6 | HO6 | 62.8° | 57.5° |
| C7 | C8 | C9 | H9 | 54.4° | 161.4° |
| C7 | C8 | C9 | H9A | 174.5° | 78.4° |
| C11 | C7 | C8 | O7 | 81.8° | 38.3° |
| C11 | C7 | C8 | C9 | 154.9° | 159.6° |
| C7 | C11 | O11 | C12 | 112.1° | 114.9° |
| C7 | C11 | O11 | C34 | 125.0° | 122.5° |
| C7 | C11 | C12 | C34 | 119.0° | 118.8° |
| C7 | C11 | C12 | O12 | 156.0° | 156.7° |
| C11 | C7 | C6 | H6 | 97.1° | 101.8° |
| C11 | C7 | O6 | HO6 | 65.7° | 67.2° |
| C11 | C7 | C8 | H8 | 36.2° | 79.3° |
| C7 | C11 | O11 | HO11 | 26.1° | 179.9° |
| C7 | C11 | C34 | H34 | 180.0° | 60.0° |
| C7 | C11 | C34 | H34A | 60.0° | 180.0° |
| C7 | C11 | C34 | H34B | 60.0° | 59.9° |
| O7 | C8 | C9 | H8 | 118.2° | 117.6° |
| C8 | O7 | C27 | O8 | 5.8° | 0.0° |
| O7 | C8 | C9 | C10 | 59.0° | 162.6° |
| C8 | O7 | C27 | C28 | 176.3° | 180.0° |
| O7 | C8 | C9 | H9 | 179.0° | 77.4° |
| O7 | C8 | C9 | H9A | 61.0° | 42.8° |
| C27 | O7 | C8 | C9 | 143.5° | 85.3° |
| O7 | C27 | O8 | C28 | 177.8° | 180.0° |
| O7 | C27 | C28 | C29 | 175.7° | 180.0° |
| C27 | O7 | C8 | H8 | 24.8° | 32.3° |
| O7 | C27 | C28 | H28 | 64.3° | 59.9° |
| O7 | C27 | C28 | H28A | 55.7° | 60.0° |
| C8 | C9 | C10 | H9 | 120.0° | 119.8° |
| C8 | C9 | C10 | H9A | 120.0° | 119.6° |
| C8 | C9 | C10 | O9 | 176.1° | 28.1° |
| C8 | C9 | C10 | C31 | 65.0° | 146.3° |
| C8 | C9 | H9 | H9A | 116.9° | 120.1° |
| O8 | C27 | C28 | C29 | 2.2° | 0.0° |
| O8 | C27 | C28 | H28 | 117.8° | 120.1° |
| O8 | C27 | C28 | H28A | 122.2° | 120.0° |
| C9 | C10 | O9 | C31 | 120.3° | 118.4° |
| C9 | C10 | O9 | C32 | 61.5° | 56.6° |
| C9 | C10 | C1 | H1 | 41.8° | 167.1° |
| C10 | C9 | C8 | H8 | 177.2° | 79.8° |
| C10 | C9 | H9 | H9A | 116.9° | 120.7° |
| C9 | C10 | C31 | H31 | 52.0° | 176.5° |
| C9 | C10 | C31 | H31A | 68.0° | 56.5° |
| C9 | C10 | C31 | H31B | 172.0° | 63.6° |
| C10 | O9 | C32 | O10 | 1.3° | 0.0° |
| C10 | O9 | C32 | C33 | 177.6° | 180.0° |
| O9 | C10 | C1 | H1 | 73.5° | 72.1° |
| O9 | C10 | C9 | H9 | 56.1° | 91.7° |
| O9 | C10 | C9 | H9A | 63.9° | 147.7° |
| O9 | C10 | C31 | H31 | 65.6° | 58.2° |
| O9 | C10 | C31 | H31A | 174.4° | 61.9° |
| O9 | C10 | C31 | H31B | 54.4° | 178.1° |
| C32 | O9 | C10 | C31 | 58.8° | 61.9° |
| O9 | C32 | O10 | C33 | 178.9° | 180.0° |
| O9 | C32 | C33 | H33 | 178.9° | 90.0° |
| O9 | C32 | C33 | H33A | 61.1° | 150.0° |
| O9 | C32 | C33 | H33B | 58.9° | 30.0° |
| C31 | C10 | C1 | H1 | 168.7° | 46.0° |
| C31 | C10 | C9 | H9 | 175.1° | 26.6° |
| C31 | C10 | C9 | H9A | 55.0° | 94.1° |
| C10 | C31 | H31 | H31A | 120.0° | 120.0° |
| C10 | C31 | H31 | H31B | 120.0° | 119.9° |
| C10 | C31 | H31A | H31B | 120.0° | 120.0° |
| O10 | C32 | C33 | H33 | 0.0° | 90.0° |
| O10 | C32 | C33 | H33A | 120.0° | 30.0° |
| O10 | C32 | C33 | H33B | 120.0° | 150.0° |
| O11 | C11 | C12 | C34 | 122.4° | 122.5° |
| O11 | C11 | C12 | O12 | 37.4° | 38.0° |
| O11 | C11 | C34 | H34 | 55.4° | 177.5° |
| O11 | C11 | C34 | H34A | 64.6° | 57.5° |
| O11 | C11 | C34 | H34B | 175.4° | 62.5° |
| C12 | C11 | O11 | HO11 | 86.0° | 65.1° |
| C12 | C11 | C34 | H34 | 68.1° | 54.9° |
| C12 | C11 | C34 | H34A | 172.0° | 65.1° |
| C12 | C11 | C34 | H34B | 51.9° | 174.9° |
| C34 | C11 | C12 | O12 | 85.0° | 84.5° |
| C34 | C11 | O11 | HO11 | 151.1° | 57.5° |
| C11 | C34 | H34 | H34A | 120.0° | 120.0° |
| C11 | C34 | H34 | H34B | 120.0° | 120.0° |
| C11 | C34 | H34A | H34B | 120.0° | 120.0° |
| C21 | C22 | C23 | C24 | 180.0° | 180.0° |
| C21 | C22 | C24 | C25 | 0.1° | 0.1° |
| C21 | C22 | C23 | H23 | 180.0° | 90.0° |
| C21 | C22 | C23 | H23A | 60.0° | 150.0° |
| C21 | C22 | C23 | H23B | 60.0° | 30.0° |
| C21 | C22 | C24 | H24 | 179.9° | 180.0° |
| C23 | C22 | C24 | C25 | 179.9° | 179.9° |
| C22 | C23 | H23 | H23A | 120.0° | 119.9° |
| C22 | C23 | H23 | H23B | 120.0° | 120.0° |
| C22 | C23 | H23A | H23B | 120.0° | 120.0° |
| C23 | C22 | C24 | H24 | 0.1° | 0.0° |
| C22 | C24 | C25 | H24 | 180.0° | 180.0° |
| C24 | C22 | C23 | H23 | 0.0° | 90.0° |
| C24 | C22 | C23 | H23A | 120.0° | 30.0° |
| C24 | C22 | C23 | H23B | 120.0° | 150.0° |
| C22 | C24 | C25 | H25 | 180.0° | 60.1° |
| C22 | C24 | C25 | H25A | 60.0° | 180.0° |
| C22 | C24 | C25 | H25B | 60.0° | 60.0° |
| C24 | C25 | H25 | H25A | 120.0° | 119.9° |
| C24 | C25 | H25 | H25B | 120.0° | 120.1° |
| C24 | C25 | H25A | H25B | 120.0° | 120.1° |
| C27 | C28 | C29 | H28 | 120.0° | 120.0° |
| C27 | C28 | C29 | H28A | 120.0° | 120.0° |
| C27 | C28 | C29 | C30 | 179.1° | 180.0° |
| C27 | C28 | H28 | H28A | 118.8° | 119.9° |
| C27 | C28 | C29 | H29 | 60.9° | 60.0° |
| C27 | C28 | C29 | H29A | 59.1° | 60.0° |
| C28 | C29 | C30 | H29 | 120.0° | 120.0° |
| C28 | C29 | C30 | H29A | 120.0° | 120.0° |
| C29 | C28 | H28 | H28A | 118.8° | 120.0° |
| C28 | C29 | H29 | H29A | 119.2° | 120.0° |
| C28 | C29 | C30 | H30 | 180.0° | 180.0° |
| C28 | C29 | C30 | H30A | 60.0° | 60.0° |
| C28 | C29 | C30 | H30B | 60.0° | 59.9° |
| C30 | C29 | C28 | H28 | 59.1° | 60.0° |
| C30 | C29 | C28 | H28A | 60.9° | 60.0° |
| C30 | C29 | H29 | H29A | 119.2° | 120.0° |
| C29 | C30 | H30 | H30A | 120.0° | 120.0° |
| C29 | C30 | H30 | H30B | 120.0° | 120.0° |
| C29 | C30 | H30A | H30B | 120.0° | 120.0° |
| C32 | C33 | H33 | H33A | 120.0° | 120.0° |
| C32 | C33 | H33 | H33B | 120.0° | 120.0° |
| C32 | C33 | H33A | H33B | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 35.9° | 46.1° |
| H1 | C1 | C2 | H2A | 84.1° | 169.4° |
| H1 | C1 | C5 | H5 | 48.2° | 43.8° |
| H2 | C2 | C3 | H3 | 16.1° | 27.3° |
| H2A | C2 | C3 | H3 | 103.8° | 150.7° |
| H3 | C3 | C4 | H4 | 134.0° | 124.5° |
| H4 | C4 | C5 | H5 | 157.1° | 99.5° |
| H4 | C4 | C26 | H26 | 57.0° | 60.4° |
| H4 | C4 | C26 | H26A | 177.0° | 59.6° |
| H4 | C4 | C26 | H26B | 63.0° | 179.6° |
| H5 | C5 | C6 | H6 | 152.1° | 173.7° |
| H8 | C8 | C9 | H9 | 62.8° | 40.2° |
| H8 | C8 | C9 | H9A | 57.2° | 160.4° |
| H23 | C23 | H23A | H23B | 120.0° | 120.0° |
| H24 | C24 | C25 | H25 | 0.0° | 120.0° |
| H24 | C24 | C25 | H25A | 120.0° | 0.1° |
| H24 | C24 | C25 | H25B | 120.0° | 120.0° |
| H25 | C25 | H25A | H25B | 120.0° | 120.0° |
| H26 | C26 | H26A | H26B | 120.0° | 120.0° |
| H28 | C28 | C29 | H29 | 179.1° | 180.0° |
| H28 | C28 | C29 | H29A | 60.9° | 60.1° |
| H28A | C28 | C29 | H29 | 59.1° | 60.0° |
| H28A | C28 | C29 | H29A | 179.1° | 180.0° |
| H29 | C29 | C30 | H30 | 60.0° | 60.0° |
| H29 | C29 | C30 | H30A | 180.0° | 179.9° |
| H29 | C29 | C30 | H30B | 60.0° | 60.0° |
| H29A | C29 | C30 | H30 | 60.0° | 60.0° |
| H29A | C29 | C30 | H30A | 60.0° | 60.1° |
| H29A | C29 | C30 | H30B | 179.9° | 180.0° |
| H30 | C30 | H30A | H30B | 120.0° | 120.0° |
| H31 | C31 | H31A | H31B | 120.0° | 120.0° |
| H33 | C33 | H33A | H33B | 120.0° | 120.0° |
| H34 | C34 | H34A | H34B | 120.0° | 120.0° |
