KWT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.45Å | 1.46Å | |
| C1 | C9 | sing | 1.53Å | 1.58Å | |
| C1 | C23 | sing | 1.53Å | 1.56Å | |
| C1 | HC1 | sing | 1.08Å | 1.12Å | |
| O1 | C2 | sing | 1.36Å | 1.43Å | |
| C9 | C4 | sing | 1.50Å | 1.64Å | |
| C9 | C8 | sing | 1.51Å | 1.63Å | |
| C9 | C10 | sing | 1.53Å | 1.58Å | |
| C23 | O8 | sing | 1.43Å | 1.43Å | |
| C23 | H231 | sing | 1.09Å | 1.11Å | |
| C23 | H232 | sing | 1.09Å | 1.11Å | |
| C2 | O2 | doub | 1.22Å | 1.23Å | |
| C2 | C3 | sing | 1.48Å | 1.59Å | |
| C3 | C4 | sing | 1.42Å | 1.42Å | Aromatic |
| C3 | C19 | doub | 1.35Å | 1.36Å | Aromatic |
| C4 | C5 | doub | 1.35Å | 1.42Å | Aromatic |
| C19 | O5 | sing | 1.36Å | 3.09Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.10Å | |
| C5 | C6 | sing | 1.47Å | 1.54Å | |
| C5 | O5 | sing | 1.33Å | 1.38Å | Aromatic |
| C6 | O3 | doub | 1.22Å | 1.25Å | |
| C6 | C7 | sing | 1.49Å | 1.54Å | |
| C7 | C8 | doub | 1.34Å | 1.41Å | |
| C7 | C15 | sing | 1.49Å | 1.59Å | |
| O6 | C11 | sing | 1.45Å | 1.48Å | |
| O6 | C21 | sing | 1.34Å | 1.41Å | |
| C11 | C8 | sing | 1.51Å | 1.61Å | |
| C11 | C12 | sing | 1.53Å | 1.57Å | |
| C11 | H11 | sing | 1.09Å | 1.12Å | |
| C21 | O7 | doub | 1.21Å | 1.24Å | |
| C21 | C22 | sing | 1.51Å | 1.53Å | |
| C15 | C13 | sing | 1.55Å | 1.58Å | |
| C15 | C16 | sing | 1.53Å | 1.55Å | |
| C15 | H15 | sing | 1.09Å | 1.11Å | |
| C10 | H101 | sing | 1.09Å | 1.11Å | |
| C10 | H102 | sing | 1.09Å | 1.11Å | |
| C10 | H103 | sing | 1.09Å | 1.12Å | |
| C12 | C13 | sing | 1.51Å | 1.57Å | |
| C12 | H121 | sing | 1.09Å | 1.11Å | |
| C12 | H122 | sing | 1.09Å | 1.12Å | |
| C13 | C14 | sing | 1.53Å | 1.57Å | |
| C13 | C18 | sing | 1.50Å | 1.51Å | |
| C14 | H141 | sing | 1.09Å | 1.12Å | |
| C14 | H142 | sing | 1.09Å | 1.12Å | |
| C14 | H143 | sing | 1.09Å | 1.11Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| C18 | O4 | doub | 1.21Å | 1.22Å | |
| C16 | C17 | sing | 1.55Å | 1.52Å | |
| C16 | H161 | sing | 1.09Å | 1.12Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C17 | H171 | sing | 1.09Å | 1.11Å | |
| C17 | H172 | sing | 1.09Å | 1.12Å | |
| C22 | H221 | sing | 1.09Å | 1.12Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C22 | H223 | sing | 1.09Å | 1.11Å | |
| O8 | C24 | sing | 1.43Å | 1.44Å | |
| C24 | H241 | sing | 1.09Å | 1.11Å | |
| C24 | H242 | sing | 1.09Å | 1.12Å | |
| C24 | H243 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C9 | 109.9° | 112.2° |
| O1 | C1 | C23 | 105.9° | 106.8° |
| O1 | C1 | HC1 | 113.5° | 108.5° |
| C1 | O1 | C2 | 125.9° | 124.4° |
| C9 | C1 | C23 | 114.9° | 108.9° |
| C9 | C1 | HC1 | 104.3° | 110.3° |
| C1 | C9 | C4 | 105.6° | 104.3° |
| C1 | C9 | C8 | 112.3° | 114.9° |
| C1 | C9 | C10 | 111.6° | 109.2° |
| C23 | C1 | HC1 | 108.5° | 110.2° |
| C1 | C23 | O8 | 112.2° | 109.5° |
| C1 | C23 | H231 | 111.2° | 109.4° |
| C1 | C23 | H232 | 111.2° | 109.5° |
| O1 | C2 | O2 | 120.2° | 122.7° |
| O1 | C2 | C3 | 115.7° | 114.5° |
| C4 | C9 | C8 | 116.5° | 110.0° |
| C4 | C9 | C10 | 107.4° | 108.8° |
| C9 | C4 | C3 | 117.7° | 122.6° |
| C9 | C4 | C5 | 117.4° | 129.4° |
| C8 | C9 | C10 | 103.3° | 109.4° |
| C9 | C8 | C7 | 121.4° | 121.3° |
| C9 | C8 | C11 | 118.6° | 116.4° |
| C9 | C10 | H101 | 111.7° | 109.4° |
| C9 | C10 | H102 | 111.4° | 109.5° |
| C9 | C10 | H103 | 111.5° | 109.5° |
| O8 | C23 | H231 | 111.2° | 109.4° |
| O8 | C23 | H232 | 111.2° | 109.5° |
| C23 | O8 | C24 | 113.0° | 106.8° |
| H231 | C23 | H232 | 99.2° | 109.5° |
| O2 | C2 | C3 | 124.1° | 122.9° |
| C2 | C3 | C4 | 117.2° | 115.7° |
| C2 | C3 | C19 | 110.6° | 138.8° |
| C4 | C3 | C19 | 132.1° | 105.5° |
| C3 | C4 | C5 | 124.8° | 108.0° |
| C3 | C19 | O5 | 72.7° | 108.5° |
| C3 | C19 | H19 | 127.7° | 125.8° |
| C4 | C5 | C6 | 124.4° | 116.7° |
| C4 | C5 | O5 | 123.2° | 107.9° |
| O5 | C19 | H19 | 159.6° | 125.7° |
| C19 | O5 | C5 | 81.4° | 109.9° |
| C6 | C5 | O5 | 112.4° | 135.4° |
| C5 | C6 | O3 | 117.5° | 121.4° |
| C5 | C6 | C7 | 119.9° | 116.3° |
| O3 | C6 | C7 | 122.6° | 122.4° |
| C6 | C7 | C8 | 120.5° | 124.2° |
| C6 | C7 | C15 | 120.8° | 116.3° |
| C8 | C7 | C15 | 118.8° | 119.5° |
| C7 | C8 | C11 | 120.0° | 122.3° |
| C7 | C15 | C13 | 113.5° | 108.9° |
| C7 | C15 | C16 | 122.9° | 117.6° |
| C7 | C15 | H15 | 93.9° | 109.2° |
| C11 | O6 | C21 | 123.1° | 120.1° |
| O6 | C11 | C8 | 110.9° | 110.1° |
| O6 | C11 | C12 | 103.6° | 107.1° |
| O6 | C11 | H11 | 114.7° | 107.2° |
| O6 | C21 | O7 | 126.6° | 119.9° |
| O6 | C21 | C22 | 111.1° | 120.1° |
| C8 | C11 | C12 | 115.7° | 115.6° |
| C8 | C11 | H11 | 102.5° | 108.5° |
| C12 | C11 | H11 | 109.9° | 108.0° |
| C11 | C12 | C13 | 113.5° | 108.7° |
| C11 | C12 | H121 | 110.8° | 109.7° |
| C11 | C12 | H122 | 110.8° | 109.6° |
| O7 | C21 | C22 | 122.3° | 120.0° |
| C21 | C22 | H221 | 111.0° | 109.6° |
| C21 | C22 | H222 | 111.6° | 109.5° |
| C21 | C22 | H223 | 111.6° | 109.4° |
| C13 | C15 | C16 | 100.1° | 101.8° |
| C13 | C15 | H15 | 119.1° | 109.7° |
| C15 | C13 | C12 | 103.0° | 105.4° |
| C15 | C13 | C14 | 117.2° | 111.5° |
| C15 | C13 | C18 | 98.4° | 102.6° |
| C16 | C15 | H15 | 108.8° | 109.3° |
| C15 | C16 | C17 | 102.9° | 102.7° |
| C15 | C16 | H161 | 114.6° | 111.6° |
| C15 | C16 | H162 | 114.7° | 110.6° |
| H101 | C10 | H102 | 111.3° | 109.4° |
| H101 | C10 | H103 | 111.4° | 109.5° |
| H102 | C10 | H103 | 98.9° | 109.5° |
| C13 | C12 | H121 | 110.8° | 110.0° |
| C13 | C12 | H122 | 110.7° | 109.8° |
| C12 | C13 | C14 | 111.9° | 111.0° |
| C12 | C13 | C18 | 115.9° | 116.8° |
| H121 | C12 | H122 | 99.5° | 109.0° |
| C14 | C13 | C18 | 109.9° | 109.3° |
| C13 | C14 | H141 | 117.3° | 109.4° |
| C13 | C14 | H142 | 109.5° | 109.4° |
| C13 | C14 | H143 | 109.4° | 109.4° |
| C13 | C18 | C17 | 110.9° | 105.4° |
| C13 | C18 | O4 | 124.0° | 127.1° |
| H141 | C14 | H142 | 109.4° | 109.5° |
| H141 | C14 | H143 | 109.3° | 109.5° |
| H142 | C14 | H143 | 100.7° | 109.5° |
| C17 | C18 | O4 | 125.0° | 127.5° |
| C18 | C17 | C16 | 102.2° | 106.8° |
| C18 | C17 | H171 | 115.0° | 110.1° |
| C18 | C17 | H172 | 114.9° | 110.1° |
| C17 | C16 | H161 | 114.7° | 111.2° |
| C17 | C16 | H162 | 114.7° | 110.4° |
| C16 | C17 | H171 | 115.0° | 110.0° |
| C16 | C17 | H172 | 115.0° | 110.0° |
| H161 | C16 | H162 | 95.8° | 110.2° |
| H171 | C17 | H172 | 95.5° | 109.9° |
| H221 | C22 | H222 | 111.6° | 109.4° |
| H221 | C22 | H223 | 111.6° | 109.5° |
| H222 | C22 | H223 | 98.8° | 109.4° |
| O8 | C24 | H241 | 113.0° | 109.5° |
| O8 | C24 | H242 | 110.9° | 109.4° |
| O8 | C24 | H243 | 110.9° | 109.4° |
| H241 | C24 | H242 | 111.0° | 109.5° |
| H241 | C24 | H243 | 111.0° | 109.5° |
| H242 | C24 | H243 | 99.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C9 | C23 | 119.3° | 117.9° |
| O1 | C1 | C9 | HC1 | 122.1° | 121.0° |
| O1 | C1 | C23 | HC1 | 122.2° | 117.7° |
| O1 | C1 | C9 | C4 | 54.5° | 51.6° |
| O1 | C1 | C9 | C8 | 177.5° | 172.1° |
| O1 | C1 | C9 | C10 | 62.0° | 64.6° |
| O1 | C1 | C23 | O8 | 58.3° | 57.7° |
| O1 | C1 | C23 | H231 | 176.5° | 62.3° |
| O1 | C1 | C23 | H232 | 67.0° | 177.7° |
| C1 | O1 | C2 | O2 | 164.3° | 162.7° |
| C1 | O1 | C2 | C3 | 16.0° | 17.0° |
| C9 | C1 | C23 | HC1 | 116.3° | 121.1° |
| C9 | C1 | O1 | C2 | 41.6° | 26.5° |
| C1 | C9 | C4 | C8 | 125.5° | 123.7° |
| C1 | C9 | C4 | C10 | 119.3° | 116.4° |
| C1 | C9 | C8 | C10 | 120.5° | 123.2° |
| C9 | C1 | C23 | O8 | 179.8° | 179.0° |
| C9 | C1 | C23 | H231 | 55.0° | 59.0° |
| C9 | C1 | C23 | H232 | 54.5° | 61.0° |
| C1 | C9 | C4 | C3 | 53.3° | 41.5° |
| C1 | C9 | C4 | C5 | 125.4° | 136.5° |
| C1 | C9 | C8 | C7 | 122.4° | 127.7° |
| C1 | C9 | C8 | C11 | 58.0° | 54.5° |
| C1 | C9 | C10 | H101 | 180.0° | 53.5° |
| C1 | C9 | C10 | H102 | 54.8° | 173.4° |
| C1 | C9 | C10 | H103 | 54.7° | 66.5° |
| C23 | C1 | O1 | C2 | 83.0° | 92.7° |
| C23 | C1 | C9 | C4 | 64.8° | 66.3° |
| C23 | C1 | C9 | C8 | 63.2° | 54.2° |
| C23 | C1 | C9 | C10 | 178.7° | 177.5° |
| C1 | C23 | O8 | H231 | 125.2° | 119.9° |
| C1 | C23 | O8 | H232 | 125.2° | 120.0° |
| C1 | C23 | H231 | H232 | 117.1° | 120.0° |
| C1 | C23 | O8 | C24 | 178.7° | 180.0° |
| HC1 | C1 | O1 | C2 | 158.0° | 148.5° |
| HC1 | C1 | C9 | C4 | 176.5° | 172.6° |
| HC1 | C1 | C9 | C8 | 55.5° | 66.9° |
| HC1 | C1 | C9 | C10 | 60.1° | 56.4° |
| HC1 | C1 | C23 | O8 | 64.0° | 60.0° |
| HC1 | C1 | C23 | H231 | 61.3° | 179.9° |
| HC1 | C1 | C23 | H232 | 170.8° | 60.1° |
| O1 | C2 | O2 | C3 | 179.7° | 179.8° |
| O1 | C2 | C3 | C4 | 9.2° | 29.8° |
| O1 | C2 | C3 | C19 | 173.1° | 150.0° |
| C4 | C9 | C8 | C10 | 117.5° | 119.5° |
| C9 | C4 | C3 | C2 | 30.4° | 1.6° |
| C9 | C4 | C3 | C5 | 178.6° | 178.4° |
| C9 | C4 | C3 | C19 | 152.6° | 178.5° |
| C9 | C4 | C5 | C6 | 0.8° | 2.4° |
| C9 | C4 | C5 | O5 | 179.1° | 178.3° |
| C4 | C9 | C8 | C7 | 0.4° | 10.3° |
| C4 | C9 | C8 | C11 | 180.0° | 171.9° |
| C4 | C9 | C10 | H101 | 64.6° | 59.8° |
| C4 | C9 | C10 | H102 | 170.2° | 60.1° |
| C4 | C9 | C10 | H103 | 60.7° | 179.8° |
| C8 | C9 | C4 | C3 | 178.8° | 165.3° |
| C8 | C9 | C4 | C5 | 0.1° | 12.8° |
| C9 | C8 | C7 | C6 | 0.1° | 1.1° |
| C9 | C8 | C7 | C11 | 179.6° | 177.7° |
| C9 | C8 | C7 | C15 | 178.4° | 177.9° |
| C9 | C8 | C11 | O6 | 63.9° | 57.7° |
| C9 | C8 | C11 | C12 | 178.5° | 179.1° |
| C9 | C8 | C11 | H11 | 59.0° | 59.3° |
| C8 | C9 | C10 | H101 | 59.0° | 180.0° |
| C8 | C9 | C10 | H102 | 66.2° | 60.1° |
| C8 | C9 | C10 | H103 | 175.7° | 60.0° |
| C10 | C9 | C4 | C3 | 66.0° | 74.9° |
| C10 | C9 | C4 | C5 | 115.3° | 107.1° |
| C10 | C9 | C8 | C7 | 117.1° | 109.1° |
| C10 | C9 | C8 | C11 | 62.5° | 68.7° |
| C9 | C10 | H101 | H102 | 125.3° | 120.0° |
| C9 | C10 | H101 | H103 | 125.3° | 120.0° |
| C9 | C10 | H102 | H103 | 117.4° | 120.1° |
| O8 | C23 | H231 | H232 | 117.1° | 120.0° |
| C23 | O8 | C24 | H241 | 180.0° | 180.0° |
| C23 | O8 | C24 | H242 | 54.7° | 60.0° |
| C23 | O8 | C24 | H243 | 54.7° | 60.0° |
| H231 | C23 | O8 | C24 | 53.4° | 60.1° |
| H232 | C23 | O8 | C24 | 56.1° | 60.0° |
| O2 | C2 | C3 | C4 | 171.1° | 150.0° |
| O2 | C2 | C3 | C19 | 6.6° | 30.2° |
| C2 | C3 | C4 | C19 | 177.0° | 179.9° |
| C2 | C3 | C4 | C5 | 148.2° | 176.8° |
| C2 | C3 | C19 | O5 | 153.8° | 178.3° |
| C2 | C3 | C19 | H19 | 26.2° | 1.5° |
| C4 | C3 | C19 | O5 | 23.3° | 1.5° |
| C4 | C3 | C19 | H19 | 156.6° | 178.7° |
| C3 | C4 | C5 | C6 | 179.5° | 175.8° |
| C3 | C4 | C5 | O5 | 0.5° | 3.5° |
| C19 | C3 | C4 | C5 | 28.8° | 3.1° |
| C3 | C19 | O5 | H19 | 179.9° | 179.8° |
| C3 | C19 | O5 | C5 | 17.5° | 0.6° |
| C4 | C5 | O5 | C19 | 8.8° | 2.6° |
| C4 | C5 | C6 | O5 | 179.9° | 179.1° |
| C4 | C5 | C6 | O3 | 178.9° | 169.6° |
| C4 | C5 | C6 | C7 | 1.1° | 10.3° |
| C19 | O5 | C5 | C6 | 171.3° | 176.5° |
| H19 | C19 | O5 | C5 | 162.4° | 179.2° |
| C5 | C6 | O3 | C7 | 179.9° | 179.9° |
| C5 | C6 | C7 | C8 | 0.6° | 12.3° |
| C5 | C6 | C7 | C15 | 179.0° | 166.7° |
| O5 | C5 | C6 | O3 | 1.1° | 11.3° |
| O5 | C5 | C6 | C7 | 178.8° | 168.8° |
| O3 | C6 | C7 | C8 | 179.5° | 167.6° |
| O3 | C6 | C7 | C15 | 1.0° | 13.4° |
| C6 | C7 | C8 | C15 | 178.5° | 179.0° |
| C6 | C7 | C8 | C11 | 179.7° | 176.6° |
| C6 | C7 | C15 | C13 | 145.7° | 144.6° |
| C6 | C7 | C15 | C16 | 25.2° | 29.6° |
| C6 | C7 | C15 | H15 | 90.2° | 95.7° |
| C7 | C8 | C11 | O6 | 116.5° | 124.5° |
| C7 | C8 | C11 | C12 | 1.1° | 3.1° |
| C7 | C8 | C11 | H11 | 120.6° | 118.4° |
| C8 | C7 | C15 | C13 | 32.8° | 36.4° |
| C8 | C7 | C15 | C16 | 153.3° | 151.4° |
| C8 | C7 | C15 | H15 | 91.3° | 83.3° |
| C15 | C7 | C8 | C11 | 1.2° | 4.5° |
| C7 | C15 | C13 | C16 | 132.7° | 124.9° |
| C7 | C15 | C13 | H15 | 109.0° | 119.4° |
| C7 | C15 | C16 | H15 | 107.8° | 125.2° |
| C7 | C15 | C13 | C12 | 62.6° | 66.6° |
| C7 | C15 | C13 | C14 | 60.8° | 53.8° |
| C7 | C15 | C13 | C18 | 178.3° | 170.6° |
| C7 | C15 | C16 | C17 | 175.7° | 158.0° |
| C7 | C15 | C16 | H161 | 50.5° | 38.9° |
| C7 | C15 | C16 | H162 | 59.0° | 84.2° |
| O6 | C11 | C8 | C12 | 117.6° | 121.4° |
| O6 | C11 | C8 | H11 | 122.9° | 117.1° |
| O6 | C11 | C12 | H11 | 123.0° | 115.2° |
| C11 | O6 | C21 | O7 | 0.3° | 0.1° |
| C11 | O6 | C21 | C22 | 179.3° | 179.9° |
| O6 | C11 | C12 | C13 | 154.8° | 157.5° |
| O6 | C11 | C12 | H121 | 29.5° | 37.2° |
| O6 | C11 | C12 | H122 | 79.9° | 82.5° |
| C21 | O6 | C11 | C8 | 147.9° | 150.0° |
| C21 | O6 | C11 | C12 | 87.3° | 83.6° |
| C21 | O6 | C11 | H11 | 32.5° | 32.1° |
| O6 | C21 | O7 | C22 | 179.5° | 180.0° |
| O6 | C21 | C22 | H221 | 180.0° | 180.0° |
| O6 | C21 | C22 | H222 | 54.8° | 59.9° |
| O6 | C21 | C22 | H223 | 54.8° | 60.0° |
| C8 | C11 | C12 | H11 | 115.4° | 121.8° |
| C8 | C11 | C12 | C13 | 33.2° | 34.5° |
| C8 | C11 | C12 | H121 | 92.1° | 85.9° |
| C8 | C11 | C12 | H122 | 158.5° | 154.5° |
| C11 | C12 | C13 | C15 | 62.6° | 65.1° |
| C11 | C12 | C13 | H121 | 125.3° | 120.2° |
| C11 | C12 | C13 | H122 | 125.3° | 119.9° |
| C11 | C12 | H121 | H122 | 116.6° | 120.0° |
| C11 | C12 | C13 | C14 | 64.2° | 55.7° |
| C11 | C12 | C13 | C18 | 168.8° | 178.2° |
| H11 | C11 | C12 | C13 | 82.2° | 87.3° |
| H11 | C11 | C12 | H121 | 152.5° | 152.3° |
| H11 | C11 | C12 | H122 | 43.1° | 32.7° |
| O7 | C21 | C22 | H221 | 0.4° | 0.0° |
| O7 | C21 | C22 | H222 | 124.8° | 120.1° |
| O7 | C21 | C22 | H223 | 125.7° | 120.0° |
| C21 | C22 | H221 | H222 | 125.2° | 120.1° |
| C21 | C22 | H221 | H223 | 125.2° | 120.0° |
| C21 | C22 | H222 | H223 | 117.6° | 119.9° |
| C13 | C15 | C16 | H15 | 125.6° | 115.9° |
| C15 | C13 | C12 | C14 | 126.8° | 120.8° |
| C15 | C13 | C12 | C18 | 106.2° | 113.1° |
| C15 | C13 | C12 | H121 | 62.7° | 55.2° |
| C15 | C13 | C12 | H122 | 172.1° | 175.1° |
| C15 | C13 | C14 | C18 | 111.1° | 112.7° |
| C15 | C13 | C14 | H141 | 180.0° | 176.4° |
| C15 | C13 | C14 | H142 | 54.8° | 56.4° |
| C15 | C13 | C14 | H143 | 54.7° | 63.6° |
| C15 | C13 | C18 | C17 | 27.7° | 33.7° |
| C15 | C13 | C18 | O4 | 151.4° | 146.2° |
| C13 | C15 | C16 | C17 | 49.1° | 39.1° |
| C13 | C15 | C16 | H161 | 76.1° | 80.0° |
| C13 | C15 | C16 | H162 | 174.4° | 156.9° |
| C16 | C15 | C13 | C12 | 164.7° | 168.5° |
| C16 | C15 | C13 | C14 | 71.9° | 71.1° |
| C16 | C15 | C13 | C18 | 45.6° | 45.7° |
| C15 | C16 | C17 | C18 | 31.3° | 19.0° |
| C15 | C16 | C17 | H161 | 125.2° | 119.4° |
| C15 | C16 | C17 | H162 | 125.3° | 117.9° |
| C15 | C16 | H161 | H162 | 120.6° | 123.2° |
| C15 | C16 | C17 | H171 | 94.0° | 138.5° |
| C15 | C16 | C17 | H172 | 156.5° | 100.4° |
| H15 | C15 | C13 | C12 | 46.5° | 52.8° |
| H15 | C15 | C13 | C14 | 169.8° | 173.2° |
| H15 | C15 | C13 | C18 | 72.7° | 70.0° |
| H15 | C15 | C16 | C17 | 76.5° | 76.8° |
| H15 | C15 | C16 | H161 | 158.2° | 164.1° |
| H15 | C15 | C16 | H162 | 48.7° | 41.0° |
| H101 | C10 | H102 | H103 | 117.3° | 120.0° |
| C13 | C12 | H121 | H122 | 116.6° | 120.4° |
| C12 | C13 | C14 | C18 | 130.2° | 130.2° |
| C12 | C13 | C14 | H141 | 61.3° | 59.4° |
| C12 | C13 | C14 | H142 | 63.9° | 60.7° |
| C12 | C13 | C14 | H143 | 173.4° | 179.3° |
| C12 | C13 | C18 | C17 | 136.7° | 148.3° |
| C12 | C13 | C18 | O4 | 42.5° | 31.5° |
| H121 | C12 | C13 | C14 | 170.5° | 175.9° |
| H121 | C12 | C13 | C18 | 43.5° | 58.0° |
| H122 | C12 | C13 | C14 | 61.1° | 64.2° |
| H122 | C12 | C13 | C18 | 65.9° | 61.9° |
| C13 | C14 | H141 | H142 | 125.3° | 120.0° |
| C13 | C14 | H141 | H143 | 125.3° | 119.9° |
| C13 | C14 | H142 | H143 | 115.2° | 120.0° |
| C14 | C13 | C18 | C17 | 95.3° | 84.7° |
| C14 | C13 | C18 | O4 | 85.5° | 95.4° |
| C18 | C13 | C14 | H141 | 68.8° | 70.8° |
| C18 | C13 | C14 | H142 | 165.9° | 169.1° |
| C18 | C13 | C14 | H143 | 56.4° | 49.1° |
| C13 | C18 | C17 | O4 | 179.1° | 179.9° |
| C13 | C18 | C17 | C16 | 1.6° | 9.3° |
| C13 | C18 | C17 | H171 | 123.7° | 110.1° |
| C13 | C18 | C17 | H172 | 126.8° | 128.6° |
| H141 | C14 | H142 | H143 | 115.1° | 120.1° |
| C18 | C17 | C16 | H171 | 125.3° | 119.5° |
| C18 | C17 | C16 | H172 | 125.2° | 119.4° |
| C18 | C17 | C16 | H161 | 93.9° | 100.4° |
| C18 | C17 | C16 | H162 | 156.6° | 136.9° |
| C18 | C17 | H171 | H172 | 120.8° | 121.4° |
| O4 | C18 | C17 | C16 | 179.3° | 170.6° |
| O4 | C18 | C17 | H171 | 55.4° | 70.0° |
| O4 | C18 | C17 | H172 | 54.0° | 51.3° |
| C17 | C16 | H161 | H162 | 120.6° | 122.8° |
| C16 | C17 | H171 | H172 | 120.9° | 121.2° |
| H161 | C16 | C17 | H171 | 140.8° | 19.0° |
| H161 | C16 | C17 | H172 | 31.3° | 140.2° |
| H162 | C16 | C17 | H171 | 31.3° | 103.6° |
| H162 | C16 | C17 | H172 | 78.2° | 17.5° |
| H221 | C22 | H222 | H223 | 117.6° | 119.9° |
| O8 | C24 | H241 | H242 | 125.2° | 120.0° |
| O8 | C24 | H241 | H243 | 125.3° | 119.9° |
| O8 | C24 | H242 | H243 | 116.8° | 120.0° |
| H241 | C24 | H242 | H243 | 116.9° | 120.1° |
