8Z4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C28 | doub | 1.21Å | 1.22Å | |
| C28 | N | sing | 1.35Å | 1.37Å | |
| C28 | C27 | sing | 1.51Å | 1.52Å | |
| N | C1 | sing | 1.46Å | 1.49Å | |
| N | N1 | sing | 1.40Å | 1.39Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C27 | C26 | sing | 1.52Å | 1.54Å | |
| C27 | C22 | sing | 1.53Å | 1.54Å | |
| C26 | C25 | sing | 1.50Å | 1.50Å | |
| C25 | C24 | doub | 1.29Å | 1.33Å | |
| C24 | C23 | sing | 1.50Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C22 | C3 | sing | 1.52Å | 1.51Å | |
| C3 | N1 | doub | 1.30Å | 1.29Å | |
| C3 | C4 | sing | 1.47Å | 1.47Å | |
| C4 | C21 | sing | 1.40Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C21 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C9 | C7 | sing | 1.40Å | 1.40Å | Aromatic |
| C9 | C10 | sing | 1.48Å | 1.49Å | |
| C7 | O | sing | 1.36Å | 1.37Å | |
| C7 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| O | C8 | sing | 1.43Å | 1.42Å | |
| C6 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| C20 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| C13 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.48Å | 1.50Å | |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | O2 | doub | 1.22Å | 1.23Å | |
| C14 | N2 | sing | 1.35Å | 1.35Å | |
| N2 | C18 | sing | 1.47Å | 1.46Å | |
| N2 | C15 | sing | 1.48Å | 1.48Å | |
| C18 | C17 | sing | 1.54Å | 1.51Å | |
| C17 | O1 | sing | 1.43Å | 1.44Å | |
| C17 | C16 | sing | 1.55Å | 1.50Å | |
| C16 | C15 | sing | 1.55Å | 1.52Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C2 | H23C | sing | 1.09Å | 1.10Å | |
| C | HC1 | sing | 1.09Å | 1.10Å | |
| C | HC2 | sing | 1.09Å | 1.10Å | |
| C | HC3 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C8 | H83C | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O1 | HA | sing | 0.97Å | 0.95Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C28 | N | 121.4° | 121.0° |
| O3 | C28 | C27 | 120.4° | 120.9° |
| N | C28 | C27 | 118.2° | 118.0° |
| C28 | N | C1 | 125.5° | 120.1° |
| C28 | N | N1 | 122.1° | 119.7° |
| C28 | C27 | C26 | 118.8° | 112.1° |
| C28 | C27 | C22 | 109.4° | 108.6° |
| C28 | C27 | H27 | 106.0° | 108.6° |
| C1 | N | N1 | 112.4° | 120.2° |
| N | C1 | C2 | 110.3° | 109.5° |
| N | C1 | C | 110.2° | 109.5° |
| N | C1 | H1 | 108.8° | 109.5° |
| N | N1 | C3 | 119.4° | 121.4° |
| C2 | C1 | C | 110.7° | 109.4° |
| C2 | C1 | H1 | 108.4° | 109.5° |
| C1 | C2 | H21C | 109.5° | 109.5° |
| C1 | C2 | H22C | 109.5° | 109.5° |
| C1 | C2 | H23C | 109.4° | 109.5° |
| C | C1 | H1 | 108.4° | 109.5° |
| C1 | C | HC1 | 109.5° | 109.5° |
| C1 | C | HC2 | 109.5° | 109.5° |
| C1 | C | HC3 | 109.5° | 109.5° |
| C26 | C27 | C22 | 110.3° | 110.8° |
| C27 | C26 | C25 | 112.6° | 111.4° |
| C26 | C27 | H27 | 105.7° | 108.7° |
| C27 | C26 | H261 | 108.7° | 109.1° |
| C27 | C26 | H262 | 108.7° | 109.1° |
| C27 | C22 | C23 | 111.2° | 108.6° |
| C27 | C22 | C3 | 108.3° | 107.0° |
| C22 | C27 | H27 | 105.7° | 107.9° |
| C27 | C22 | H22 | 108.8° | 111.0° |
| C26 | C25 | C24 | 123.2° | 123.7° |
| C25 | C26 | H261 | 108.7° | 109.1° |
| C25 | C26 | H262 | 108.7° | 109.1° |
| C26 | C25 | H25 | 118.4° | 118.2° |
| C25 | C24 | C23 | 123.8° | 124.3° |
| C24 | C25 | H25 | 118.4° | 118.1° |
| C25 | C24 | H24 | 118.1° | 117.9° |
| C24 | C23 | C22 | 113.1° | 111.2° |
| C23 | C24 | H24 | 118.1° | 117.8° |
| C24 | C23 | H231 | 108.6° | 109.2° |
| C24 | C23 | H232 | 108.5° | 109.1° |
| C23 | C22 | C3 | 110.4° | 107.2° |
| C23 | C22 | H22 | 108.9° | 111.0° |
| C22 | C23 | H231 | 108.5° | 109.1° |
| C22 | C23 | H232 | 108.6° | 109.1° |
| C22 | C3 | N1 | 123.3° | 119.1° |
| C22 | C3 | C4 | 120.7° | 120.4° |
| C3 | C22 | H22 | 109.2° | 111.8° |
| N1 | C3 | C4 | 115.9° | 120.4° |
| C3 | C4 | C21 | 119.5° | 120.1° |
| C3 | C4 | C5 | 121.3° | 120.0° |
| C21 | C4 | C5 | 119.1° | 119.9° |
| C4 | C21 | C9 | 121.1° | 119.8° |
| C4 | C21 | H21 | 119.4° | 120.1° |
| C4 | C5 | C6 | 120.9° | 120.1° |
| C4 | C5 | H5 | 119.6° | 119.9° |
| C21 | C9 | C7 | 118.9° | 119.9° |
| C21 | C9 | C10 | 116.8° | 120.0° |
| C9 | C21 | H21 | 119.5° | 120.2° |
| C7 | C9 | C10 | 123.7° | 120.1° |
| C9 | C7 | O | 115.4° | 120.0° |
| C9 | C7 | C6 | 120.4° | 120.0° |
| C9 | C10 | C20 | 121.8° | 120.0° |
| C9 | C10 | C11 | 120.0° | 120.0° |
| O | C7 | C6 | 124.1° | 120.0° |
| C7 | O | C8 | 118.5° | 117.0° |
| C7 | C6 | C5 | 119.5° | 120.3° |
| C7 | C6 | H6 | 120.3° | 119.8° |
| O | C8 | H81C | 109.5° | 109.5° |
| O | C8 | H82C | 109.5° | 109.5° |
| O | C8 | H83C | 109.5° | 109.5° |
| C6 | C5 | H5 | 119.5° | 119.9° |
| C5 | C6 | H6 | 120.3° | 119.9° |
| C20 | C10 | C11 | 117.9° | 120.1° |
| C10 | C20 | C19 | 121.1° | 120.0° |
| C10 | C20 | H20 | 119.5° | 120.0° |
| C10 | C11 | C12 | 121.1° | 120.0° |
| C10 | C11 | H11 | 119.5° | 120.0° |
| C20 | C19 | C13 | 120.6° | 120.0° |
| C19 | C20 | H20 | 119.5° | 120.0° |
| C20 | C19 | H19 | 119.7° | 120.0° |
| C19 | C13 | C12 | 118.1° | 120.0° |
| C19 | C13 | C14 | 119.8° | 120.0° |
| C13 | C19 | H19 | 119.7° | 120.1° |
| C12 | C13 | C14 | 121.2° | 120.0° |
| C13 | C12 | C11 | 120.6° | 120.0° |
| C13 | C12 | H12 | 119.7° | 120.0° |
| C13 | C14 | O2 | 119.7° | 120.0° |
| C13 | C14 | N2 | 118.6° | 120.0° |
| C12 | C11 | H11 | 119.5° | 120.0° |
| C11 | C12 | H12 | 119.7° | 120.0° |
| O2 | C14 | N2 | 121.7° | 120.0° |
| C14 | N2 | C18 | 120.5° | 125.7° |
| C14 | N2 | C15 | 129.6° | 125.7° |
| C18 | N2 | C15 | 109.6° | 108.7° |
| N2 | C18 | C17 | 101.2° | 107.3° |
| N2 | C18 | H181 | 111.5° | 109.9° |
| N2 | C18 | H182 | 111.5° | 109.8° |
| N2 | C15 | C16 | 103.4° | 104.7° |
| N2 | C15 | H151 | 111.0° | 110.3° |
| N2 | C15 | H152 | 110.9° | 110.3° |
| C18 | C17 | O1 | 110.2° | 110.7° |
| C18 | C17 | C16 | 101.1° | 102.9° |
| C17 | C18 | H181 | 111.5° | 109.9° |
| C17 | C18 | H182 | 111.5° | 109.9° |
| C18 | C17 | H17 | 111.9° | 110.7° |
| O1 | C17 | C16 | 107.7° | 110.7° |
| O1 | C17 | H17 | 113.1° | 110.6° |
| C17 | O1 | HA | 109.5° | 114.0° |
| C17 | C16 | C15 | 102.7° | 101.5° |
| C16 | C17 | H17 | 112.1° | 110.9° |
| C17 | C16 | H161 | 111.1° | 111.0° |
| C17 | C16 | H162 | 111.1° | 111.0° |
| C16 | C15 | H151 | 110.9° | 110.5° |
| C16 | C15 | H152 | 111.0° | 110.4° |
| C15 | C16 | H161 | 111.2° | 111.2° |
| C15 | C16 | H162 | 111.1° | 110.9° |
| H21C | C2 | H22C | 109.4° | 109.5° |
| H21C | C2 | H23C | 109.5° | 109.5° |
| H22C | C2 | H23C | 109.5° | 109.4° |
| HC1 | C | HC2 | 109.5° | 109.5° |
| HC1 | C | HC3 | 109.4° | 109.4° |
| HC2 | C | HC3 | 109.5° | 109.5° |
| H261 | C26 | H262 | 109.4° | 109.0° |
| H231 | C23 | H232 | 109.5° | 109.0° |
| H81C | C8 | H82C | 109.5° | 109.5° |
| H81C | C8 | H83C | 109.4° | 109.4° |
| H82C | C8 | H83C | 109.4° | 109.5° |
| H181 | C18 | H182 | 109.5° | 110.0° |
| H151 | C15 | H152 | 109.5° | 110.4° |
| H161 | C16 | H162 | 109.5° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C28 | N | C27 | 179.2° | 179.7° |
| O3 | C28 | N | C1 | 0.0° | 3.9° |
| O3 | C28 | N | N1 | 179.3° | 176.2° |
| O3 | C28 | C27 | C26 | 18.9° | 21.0° |
| O3 | C28 | C27 | C22 | 146.8° | 143.7° |
| O3 | C28 | C27 | H27 | 99.6° | 99.2° |
| C28 | N | C1 | N1 | 179.4° | 179.9° |
| C28 | N | C1 | C2 | 108.9° | 120.0° |
| C28 | N | C1 | C | 128.7° | 120.0° |
| N | C28 | C27 | C26 | 161.8° | 158.7° |
| N | C28 | C27 | C22 | 34.0° | 36.1° |
| C28 | N | N1 | C3 | 18.4° | 25.0° |
| N | C28 | C27 | H27 | 79.6° | 81.1° |
| C28 | N | C1 | H1 | 9.9° | 0.0° |
| C27 | C28 | N | C1 | 179.2° | 175.8° |
| C27 | C28 | N | N1 | 0.1° | 4.1° |
| C28 | C27 | C26 | C22 | 127.5° | 121.5° |
| C28 | C27 | C26 | H27 | 118.7° | 120.1° |
| C28 | C27 | C22 | H27 | 113.7° | 117.6° |
| C28 | C27 | C26 | C25 | 81.8° | 75.7° |
| C28 | C27 | C22 | C23 | 73.8° | 60.6° |
| C28 | C27 | C22 | C3 | 47.7° | 54.8° |
| C28 | C27 | C26 | H261 | 38.7° | 44.8° |
| C28 | C27 | C26 | H262 | 157.7° | 163.8° |
| C28 | C27 | C22 | H22 | 166.3° | 177.0° |
| N | C1 | C2 | C | 122.2° | 120.0° |
| N | C1 | C2 | H1 | 119.0° | 120.0° |
| N | C1 | C | H1 | 119.0° | 120.0° |
| C1 | N | N1 | C3 | 162.2° | 154.9° |
| N | C1 | C2 | H21C | 180.0° | 60.0° |
| N | C1 | C2 | H22C | 60.0° | 180.0° |
| N | C1 | C2 | H23C | 60.0° | 60.1° |
| N | C1 | C | HC1 | 180.0° | 60.0° |
| N | C1 | C | HC2 | 60.0° | 180.0° |
| N | C1 | C | HC3 | 60.0° | 59.9° |
| N1 | N | C1 | C2 | 70.5° | 59.9° |
| N1 | N | C1 | C | 52.0° | 60.0° |
| N | N1 | C3 | C22 | 1.4° | 0.3° |
| N | N1 | C3 | C4 | 177.3° | 179.5° |
| N1 | N | C1 | H1 | 170.8° | 180.0° |
| C2 | C1 | C | H1 | 118.7° | 120.0° |
| C1 | C2 | H21C | H22C | 120.0° | 120.1° |
| C1 | C2 | H21C | H23C | 120.0° | 120.0° |
| C1 | C2 | H22C | H23C | 120.0° | 120.0° |
| C2 | C1 | C | HC1 | 57.8° | 180.0° |
| C2 | C1 | C | HC2 | 177.8° | 60.0° |
| C2 | C1 | C | HC3 | 62.2° | 60.1° |
| C | C1 | C2 | H21C | 57.8° | 60.0° |
| C | C1 | C2 | H22C | 62.2° | 60.1° |
| C | C1 | C2 | H23C | 177.8° | 180.0° |
| C1 | C | HC1 | HC2 | 120.0° | 120.0° |
| C1 | C | HC1 | HC3 | 120.0° | 119.9° |
| C1 | C | HC2 | HC3 | 120.0° | 120.0° |
| C26 | C27 | C22 | H27 | 113.8° | 118.9° |
| C27 | C26 | C25 | H261 | 120.5° | 120.5° |
| C27 | C26 | C25 | H262 | 120.5° | 120.5° |
| C27 | C26 | C25 | C24 | 15.6° | 15.2° |
| C26 | C27 | C22 | C23 | 58.7° | 62.9° |
| C26 | C27 | C22 | C3 | 179.8° | 178.3° |
| C27 | C26 | H261 | H262 | 118.5° | 119.1° |
| C26 | C27 | C22 | H22 | 61.2° | 59.5° |
| C27 | C26 | C25 | H25 | 164.4° | 164.8° |
| C22 | C27 | C26 | C25 | 45.7° | 45.8° |
| C27 | C22 | C23 | C24 | 40.4° | 47.2° |
| C27 | C22 | C23 | C3 | 120.2° | 115.3° |
| C27 | C22 | C23 | H22 | 119.9° | 122.4° |
| C27 | C22 | C3 | H22 | 118.3° | 121.7° |
| C27 | C22 | C3 | N1 | 35.1° | 39.7° |
| C27 | C22 | C3 | C4 | 143.5° | 140.6° |
| C22 | C27 | C26 | H261 | 166.1° | 166.2° |
| C22 | C27 | C26 | H262 | 74.8° | 74.8° |
| C27 | C22 | C23 | H231 | 80.2° | 73.3° |
| C27 | C22 | C23 | H232 | 160.9° | 167.7° |
| C26 | C25 | C24 | H25 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 3.0° | 1.1° |
| C25 | C26 | C27 | H27 | 159.5° | 164.2° |
| C25 | C26 | H261 | H262 | 118.6° | 119.1° |
| C26 | C25 | C24 | H24 | 176.9° | 179.0° |
| C25 | C24 | C23 | H24 | 180.0° | 179.9° |
| C25 | C24 | C23 | C22 | 9.8° | 17.9° |
| C24 | C25 | C26 | H261 | 136.1° | 135.7° |
| C24 | C25 | C26 | H262 | 104.8° | 105.4° |
| C25 | C24 | C23 | H231 | 110.7° | 102.6° |
| C25 | C24 | C23 | H232 | 130.4° | 138.4° |
| C24 | C23 | C22 | H231 | 120.6° | 120.5° |
| C24 | C23 | C22 | H232 | 120.5° | 120.5° |
| C24 | C23 | C22 | C3 | 160.6° | 162.5° |
| C24 | C23 | C22 | H22 | 79.5° | 75.2° |
| C23 | C24 | C25 | H25 | 177.0° | 179.0° |
| C24 | C23 | H231 | H232 | 118.3° | 119.1° |
| C23 | C22 | C3 | H22 | 119.7° | 121.9° |
| C23 | C22 | C3 | N1 | 86.9° | 76.7° |
| C23 | C22 | C3 | C4 | 94.5° | 103.0° |
| C23 | C22 | C27 | H27 | 172.5° | 178.2° |
| C22 | C23 | C24 | H24 | 170.2° | 162.2° |
| C22 | C23 | H231 | H232 | 118.3° | 119.1° |
| C22 | C3 | N1 | C4 | 178.7° | 179.8° |
| C22 | C3 | C4 | C21 | 157.7° | 180.0° |
| C22 | C3 | C4 | C5 | 24.9° | 0.3° |
| C3 | C22 | C27 | H27 | 66.0° | 62.8° |
| C3 | C22 | C23 | H231 | 40.0° | 42.0° |
| C3 | C22 | C23 | H232 | 78.9° | 77.1° |
| N1 | C3 | C4 | C21 | 21.0° | 0.3° |
| N1 | C3 | C4 | C5 | 156.4° | 179.4° |
| N1 | C3 | C22 | H22 | 153.4° | 161.4° |
| C3 | C4 | C21 | C5 | 177.5° | 179.7° |
| C3 | C4 | C21 | C9 | 177.1° | 180.0° |
| C3 | C4 | C5 | C6 | 175.7° | 179.7° |
| C4 | C3 | C22 | H22 | 25.2° | 18.8° |
| C3 | C4 | C21 | H21 | 2.8° | 0.0° |
| C3 | C4 | C5 | H5 | 4.3° | 0.0° |
| C4 | C21 | C9 | H21 | 180.0° | 180.0° |
| C4 | C21 | C9 | C7 | 1.7° | 0.0° |
| C4 | C21 | C9 | C10 | 170.2° | 180.0° |
| C21 | C4 | C5 | C6 | 1.8° | 0.5° |
| C21 | C4 | C5 | H5 | 178.2° | 179.7° |
| C5 | C4 | C21 | C9 | 0.4° | 0.3° |
| C4 | C5 | C6 | C7 | 1.1° | 0.5° |
| C4 | C5 | C6 | H5 | 180.0° | 179.7° |
| C5 | C4 | C21 | H21 | 179.6° | 179.7° |
| C4 | C5 | C6 | H6 | 178.9° | 179.7° |
| C21 | C9 | C7 | C10 | 171.3° | 180.0° |
| C21 | C9 | C7 | O | 177.7° | 180.0° |
| C21 | C9 | C7 | C6 | 2.4° | 0.0° |
| C21 | C9 | C10 | C20 | 113.1° | 50.0° |
| C21 | C9 | C10 | C11 | 73.4° | 129.7° |
| C9 | C7 | O | C6 | 179.9° | 180.0° |
| C9 | C7 | O | C8 | 171.0° | 180.0° |
| C9 | C7 | C6 | C5 | 1.0° | 0.3° |
| C7 | C9 | C10 | C20 | 75.4° | 130.0° |
| C7 | C9 | C10 | C11 | 98.0° | 50.3° |
| C7 | C9 | C21 | H21 | 178.3° | 180.0° |
| C9 | C7 | C6 | H6 | 179.0° | 180.0° |
| C10 | C9 | C7 | O | 11.0° | 0.0° |
| C10 | C9 | C7 | C6 | 168.9° | 180.0° |
| C9 | C10 | C20 | C11 | 173.6° | 179.7° |
| C9 | C10 | C20 | C19 | 169.3° | 180.0° |
| C9 | C10 | C11 | C12 | 166.9° | 179.7° |
| C10 | C9 | C21 | H21 | 9.8° | 0.0° |
| C9 | C10 | C20 | H20 | 10.7° | 0.0° |
| C9 | C10 | C11 | H11 | 13.1° | 0.0° |
| O | C7 | C6 | C5 | 179.0° | 179.7° |
| O | C7 | C6 | H6 | 0.9° | 0.0° |
| C7 | O | C8 | H81C | 180.0° | 180.0° |
| C7 | O | C8 | H82C | 60.0° | 60.0° |
| C7 | O | C8 | H83C | 60.0° | 60.0° |
| C6 | C7 | O | C8 | 9.0° | 0.0° |
| C7 | C6 | C5 | H6 | 180.0° | 179.7° |
| C7 | C6 | C5 | H5 | 178.9° | 179.7° |
| O | C8 | H81C | H82C | 120.0° | 120.0° |
| O | C8 | H81C | H83C | 120.0° | 120.0° |
| O | C8 | H82C | H83C | 120.0° | 120.0° |
| C10 | C20 | C19 | H20 | 180.0° | 179.9° |
| C10 | C20 | C19 | C13 | 2.8° | 0.0° |
| C20 | C10 | C11 | C12 | 6.8° | 0.6° |
| C20 | C10 | C11 | H11 | 173.2° | 179.7° |
| C10 | C20 | C19 | H19 | 177.2° | 179.9° |
| C11 | C10 | C20 | C19 | 4.3° | 0.3° |
| C10 | C11 | C12 | C13 | 2.3° | 0.5° |
| C10 | C11 | C12 | H11 | 180.0° | 179.7° |
| C11 | C10 | C20 | H20 | 175.7° | 179.7° |
| C10 | C11 | C12 | H12 | 177.8° | 179.6° |
| C20 | C19 | C13 | H19 | 180.0° | 180.0° |
| C20 | C19 | C13 | C12 | 7.3° | 0.0° |
| C20 | C19 | C13 | C14 | 161.9° | 180.0° |
| C19 | C13 | C12 | C14 | 169.0° | 180.0° |
| C19 | C13 | C12 | C11 | 4.8° | 0.2° |
| C19 | C13 | C14 | O2 | 37.1° | 24.6° |
| C19 | C13 | C14 | N2 | 146.1° | 155.4° |
| C13 | C19 | C20 | H20 | 177.2° | 180.0° |
| C19 | C13 | C12 | H12 | 175.2° | 180.0° |
| C13 | C12 | C11 | H12 | 180.0° | 179.8° |
| C12 | C13 | C14 | O2 | 131.7° | 155.4° |
| C12 | C13 | C14 | N2 | 45.1° | 24.6° |
| C13 | C12 | C11 | H11 | 177.7° | 179.8° |
| C12 | C13 | C19 | H19 | 172.7° | 180.0° |
| C14 | C13 | C12 | C11 | 164.2° | 179.7° |
| C13 | C14 | O2 | N2 | 176.7° | 180.0° |
| C13 | C14 | N2 | C18 | 168.0° | 174.3° |
| C13 | C14 | N2 | C15 | 5.5° | 5.5° |
| C14 | C13 | C19 | H19 | 18.2° | 0.0° |
| C14 | C13 | C12 | H12 | 15.8° | 0.1° |
| O2 | C14 | N2 | C18 | 15.2° | 5.7° |
| O2 | C14 | N2 | C15 | 171.3° | 174.5° |
| C14 | N2 | C18 | C15 | 174.7° | 179.8° |
| C14 | N2 | C18 | C17 | 147.0° | 179.0° |
| C14 | N2 | C15 | C16 | 173.7° | 155.8° |
| C14 | N2 | C18 | H181 | 28.3° | 59.5° |
| C14 | N2 | C18 | H182 | 94.3° | 61.7° |
| C14 | N2 | C15 | H151 | 67.3° | 85.3° |
| C14 | N2 | C15 | H152 | 54.6° | 37.0° |
| N2 | C18 | C17 | H181 | 118.7° | 119.5° |
| N2 | C18 | C17 | H182 | 118.7° | 119.4° |
| N2 | C18 | C17 | O1 | 69.6° | 140.6° |
| N2 | C18 | C17 | C16 | 44.2° | 22.2° |
| C18 | N2 | C15 | C16 | 0.4° | 24.4° |
| N2 | C18 | H181 | H182 | 123.8° | 121.0° |
| C18 | N2 | C15 | H151 | 118.6° | 94.5° |
| C18 | N2 | C15 | H152 | 119.4° | 143.2° |
| N2 | C18 | C17 | H17 | 163.7° | 96.3° |
| C15 | N2 | C18 | C17 | 27.7° | 1.2° |
| N2 | C15 | C16 | C17 | 27.6° | 37.3° |
| N2 | C15 | C16 | H151 | 119.0° | 118.8° |
| N2 | C15 | C16 | H152 | 119.0° | 118.8° |
| C15 | N2 | C18 | H181 | 146.3° | 120.7° |
| C15 | N2 | C18 | H182 | 91.0° | 118.2° |
| N2 | C15 | H151 | H152 | 122.8° | 122.3° |
| N2 | C15 | C16 | H161 | 146.5° | 80.8° |
| N2 | C15 | C16 | H162 | 91.3° | 155.2° |
| C18 | C17 | O1 | C16 | 109.5° | 113.5° |
| C18 | C17 | O1 | H17 | 126.0° | 123.1° |
| C18 | C17 | C16 | H17 | 119.3° | 118.4° |
| C18 | C17 | C16 | C15 | 44.6° | 35.7° |
| C17 | C18 | H181 | H182 | 123.9° | 121.1° |
| C18 | C17 | O1 | HA | 180.0° | 61.4° |
| C18 | C17 | C16 | H161 | 163.5° | 82.5° |
| C18 | C17 | C16 | H162 | 74.3° | 153.6° |
| O1 | C17 | C16 | H17 | 125.1° | 123.2° |
| O1 | C17 | C16 | C15 | 71.0° | 154.0° |
| O1 | C17 | C18 | H181 | 49.1° | 21.1° |
| O1 | C17 | C18 | H182 | 171.8° | 100.0° |
| O1 | C17 | C16 | H161 | 47.9° | 35.8° |
| O1 | C17 | C16 | H162 | 170.1° | 88.0° |
| C17 | C16 | C15 | H161 | 118.9° | 118.1° |
| C17 | C16 | C15 | H162 | 118.9° | 118.0° |
| C16 | C17 | C18 | H181 | 162.9° | 97.3° |
| C16 | C17 | C18 | H182 | 74.5° | 141.6° |
| C17 | C16 | C15 | H151 | 146.6° | 81.5° |
| C17 | C16 | C15 | H152 | 91.4° | 156.0° |
| C16 | C17 | O1 | HA | 70.5° | 175.0° |
| C17 | C16 | H161 | H162 | 123.1° | 123.9° |
| C16 | C15 | H151 | H152 | 122.8° | 122.4° |
| C15 | C16 | C17 | H17 | 163.9° | 82.8° |
| C15 | C16 | H161 | H162 | 123.1° | 123.9° |
| H27 | C27 | C26 | H261 | 80.0° | 75.3° |
| H27 | C27 | C26 | H262 | 39.0° | 43.7° |
| H27 | C27 | C22 | H22 | 52.6° | 59.4° |
| H1 | C1 | C2 | H21C | 61.0° | NaN° |
| H1 | C1 | C2 | H22C | 179.0° | 59.9° |
| H1 | C1 | C2 | H23C | 59.0° | 60.0° |
| H1 | C1 | C | HC1 | 61.0° | 60.0° |
| H1 | C1 | C | HC2 | 59.1° | 60.0° |
| H1 | C1 | C | HC3 | 179.1° | 179.9° |
| H21C | C2 | H22C | H23C | 120.0° | 120.0° |
| HC1 | C | HC2 | HC3 | 120.0° | 119.9° |
| H261 | C26 | C25 | H25 | 43.9° | 44.4° |
| H262 | C26 | C25 | H25 | 75.2° | 74.6° |
| H22 | C22 | C23 | H231 | 159.9° | 164.3° |
| H22 | C22 | C23 | H232 | 41.0° | 45.3° |
| H25 | C25 | C24 | H24 | 3.1° | 1.0° |
| H24 | C24 | C23 | H231 | 69.2° | 77.3° |
| H24 | C24 | C23 | H232 | 49.7° | 41.7° |
| H5 | C5 | C6 | H6 | 1.1° | 0.0° |
| H81C | C8 | H82C | H83C | 120.0° | 120.0° |
| H20 | C20 | C19 | H19 | 2.8° | 0.0° |
| H11 | C11 | C12 | H12 | 2.3° | 0.1° |
| H181 | C18 | C17 | H17 | 77.6° | 144.2° |
| H182 | C18 | C17 | H17 | 45.1° | 23.0° |
| H151 | C15 | C16 | H161 | 94.5° | 160.4° |
| H151 | C15 | C16 | H162 | 27.7° | 36.4° |
| H152 | C15 | C16 | H161 | 27.5° | 37.9° |
| H152 | C15 | C16 | H162 | 149.7° | 86.0° |
| H17 | C17 | O1 | HA | 54.0° | 61.7° |
| H17 | C17 | C16 | H161 | 77.2° | 159.0° |
| H17 | C17 | C16 | H162 | 45.0° | 35.2° |
