LVJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C22 | doub | 1.21Å | 1.22Å | |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C22 | N4 | sing | 1.35Å | 1.33Å | |
| C23 | C26 | sing | 1.53Å | 1.53Å | |
| C23 | C25 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| N4 | C21 | sing | 1.46Å | 1.46Å | |
| C21 | C19 | sing | 1.51Å | 1.51Å | |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.38Å | Aromatic |
| C16 | CL | sing | 1.74Å | 1.74Å | |
| C16 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | CL1 | sing | 1.74Å | 1.72Å | |
| C20 | C15 | sing | 1.39Å | 1.42Å | Aromatic |
| C15 | N3 | sing | 1.40Å | 1.42Å | |
| N3 | C1 | sing | 1.38Å | 1.36Å | |
| C1 | N1 | doub | 1.31Å | 1.31Å | Aromatic |
| C1 | N | sing | 1.37Å | 1.39Å | Aromatic |
| N1 | C2 | sing | 1.36Å | 1.40Å | Aromatic |
| C2 | C11 | sing | 1.41Å | 1.39Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | N | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.39Å | Aromatic |
| N | C | sing | 1.47Å | 1.46Å | |
| C10 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | O | sing | 1.36Å | 1.37Å | |
| C5 | C4 | doub | 1.40Å | 1.40Å | Aromatic |
| O | C6 | sing | 1.43Å | 1.43Å | |
| C6 | C7 | sing | 1.53Å | 1.55Å | |
| C7 | O1 | sing | 1.43Å | 1.44Å | |
| C7 | C9 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C4 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
| C4 | C12 | sing | 1.47Å | 1.50Å | |
| C12 | O2 | doub | 1.22Å | 1.23Å | |
| C12 | N2 | sing | 1.35Å | 1.34Å | |
| N2 | C13 | sing | 1.46Å | 1.45Å | |
| C14 | F | sing | 1.40Å | 1.33Å | |
| C14 | F1 | sing | 1.40Å | 1.33Å | |
| C14 | F2 | sing | 1.40Å | 1.33Å | |
| N4 | H4 | sing | 0.97Å | 1.00Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C26 | H263 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| N3 | H3 | sing | 0.97Å | 1.00Å | |
| C3 | HA | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C | HC1 | sing | 1.09Å | 1.10Å | |
| C | HC2 | sing | 1.09Å | 1.10Å | |
| C | HC3 | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| C9 | H91C | sing | 1.09Å | 1.10Å | |
| C9 | H92C | sing | 1.09Å | 1.10Å | |
| C9 | H93C | sing | 1.09Å | 1.10Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C8 | H83C | sing | 1.09Å | 1.10Å | |
| N2 | H2 | sing | 0.97Å | 1.00Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.59Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C22 | C23 | 122.1° | 120.0° |
| O3 | C22 | N4 | 122.7° | 120.0° |
| C23 | C22 | N4 | 115.2° | 120.0° |
| C22 | C23 | C26 | 109.8° | 109.5° |
| C22 | C23 | C25 | 109.9° | 109.5° |
| C22 | C23 | C24 | 109.8° | 109.4° |
| C22 | N4 | C21 | 122.4° | 120.0° |
| C22 | N4 | H4 | 118.8° | 120.0° |
| C26 | C23 | C25 | 109.1° | 109.5° |
| C26 | C23 | C24 | 109.2° | 109.5° |
| C23 | C26 | H261 | 109.5° | 109.5° |
| C23 | C26 | H262 | 109.5° | 109.5° |
| C23 | C26 | H263 | 109.5° | 109.5° |
| C25 | C23 | C24 | 109.0° | 109.5° |
| C23 | C25 | H251 | 109.5° | 109.5° |
| C23 | C25 | H252 | 109.5° | 109.5° |
| C23 | C25 | H253 | 109.5° | 109.4° |
| C23 | C24 | H241 | 109.5° | 109.5° |
| C23 | C24 | H242 | 109.5° | 109.4° |
| C23 | C24 | H243 | 109.5° | 109.5° |
| N4 | C21 | C19 | 113.0° | 109.4° |
| C21 | N4 | H4 | 118.8° | 120.1° |
| N4 | C21 | H211 | 108.6° | 109.5° |
| N4 | C21 | H212 | 108.6° | 109.5° |
| C21 | C19 | C18 | 121.7° | 120.0° |
| C21 | C19 | C20 | 120.4° | 119.9° |
| C19 | C21 | H211 | 108.6° | 109.5° |
| C19 | C21 | H212 | 108.6° | 109.5° |
| C18 | C19 | C20 | 117.8° | 120.1° |
| C19 | C18 | C17 | 121.2° | 120.2° |
| C19 | C18 | H18 | 119.4° | 119.9° |
| C19 | C20 | CL1 | 118.9° | 120.0° |
| C19 | C20 | C15 | 122.9° | 119.9° |
| C18 | C17 | C16 | 120.0° | 120.1° |
| C17 | C18 | H18 | 119.4° | 119.9° |
| C18 | C17 | H17 | 120.0° | 119.9° |
| C17 | C16 | CL | 118.6° | 120.1° |
| C17 | C16 | C15 | 121.9° | 119.9° |
| C16 | C17 | H17 | 120.0° | 120.0° |
| CL | C16 | C15 | 119.5° | 120.0° |
| C16 | C15 | C20 | 116.1° | 119.8° |
| C16 | C15 | N3 | 121.0° | 120.1° |
| CL1 | C20 | C15 | 118.1° | 120.1° |
| C20 | C15 | N3 | 122.9° | 120.1° |
| C15 | N3 | C1 | 122.1° | 120.0° |
| C15 | N3 | H3 | 119.0° | 120.0° |
| N3 | C1 | N1 | 127.9° | 125.0° |
| N3 | C1 | N | 118.6° | 125.1° |
| C1 | N3 | H3 | 119.0° | 120.0° |
| N1 | C1 | N | 113.5° | 109.9° |
| C1 | N1 | C2 | 104.5° | 109.6° |
| C1 | N | C11 | 105.4° | 107.4° |
| C1 | N | C | 130.2° | 126.3° |
| N1 | C2 | C11 | 110.6° | 107.1° |
| N1 | C2 | C3 | 129.5° | 133.2° |
| C11 | C2 | C3 | 119.9° | 119.7° |
| C2 | C11 | N | 105.9° | 106.1° |
| C2 | C11 | C10 | 122.2° | 120.3° |
| C2 | C3 | C4 | 119.4° | 119.8° |
| C2 | C3 | HA | 120.3° | 120.1° |
| N | C11 | C10 | 131.9° | 133.6° |
| C11 | N | C | 124.4° | 126.3° |
| C11 | C10 | C5 | 117.2° | 120.0° |
| C11 | C10 | H10 | 121.4° | 120.0° |
| N | C | HC1 | 109.5° | 109.5° |
| N | C | HC2 | 109.4° | 109.5° |
| N | C | HC3 | 109.5° | 109.5° |
| C10 | C5 | O | 121.9° | 119.9° |
| C10 | C5 | C4 | 122.4° | 120.2° |
| C5 | C10 | H10 | 121.4° | 120.0° |
| O | C5 | C4 | 115.7° | 119.9° |
| C5 | O | C6 | 118.1° | 117.1° |
| C5 | C4 | C3 | 118.9° | 120.1° |
| C5 | C4 | C12 | 125.2° | 120.0° |
| O | C6 | C7 | 102.0° | 109.5° |
| O | C6 | H61C | 111.3° | 109.5° |
| O | C6 | H62C | 111.3° | 109.5° |
| C6 | C7 | O1 | 110.6° | 109.5° |
| C6 | C7 | C9 | 108.5° | 109.4° |
| C6 | C7 | C8 | 111.4° | 109.5° |
| C7 | C6 | H61C | 111.3° | 109.5° |
| C7 | C6 | H62C | 111.3° | 109.4° |
| O1 | C7 | C9 | 107.8° | 109.5° |
| O1 | C7 | C8 | 107.7° | 109.5° |
| C7 | O1 | H1 | 109.5° | 114.0° |
| C9 | C7 | C8 | 110.8° | 109.5° |
| C7 | C9 | H91C | 109.5° | 109.5° |
| C7 | C9 | H92C | 109.5° | 109.4° |
| C7 | C9 | H93C | 109.5° | 109.5° |
| C7 | C8 | H81C | 109.5° | 109.5° |
| C7 | C8 | H82C | 109.5° | 109.5° |
| C7 | C8 | H83C | 109.5° | 109.5° |
| C3 | C4 | C12 | 115.8° | 120.0° |
| C4 | C3 | HA | 120.3° | 120.1° |
| C4 | C12 | O2 | 120.7° | 120.0° |
| C4 | C12 | N2 | 117.2° | 120.0° |
| O2 | C12 | N2 | 122.1° | 120.0° |
| C12 | N2 | C13 | 123.7° | 120.0° |
| C12 | N2 | H2 | 118.2° | 120.0° |
| C13 | N2 | H2 | 118.1° | 120.0° |
| N2 | C13 | H131 | 109.1° | 109.5° |
| N2 | C13 | H132 | 109.1° | 109.5° |
| N2 | C13 | C14 | 111.0° | 109.5° |
| F | C14 | F1 | 106.6° | 109.4° |
| F | C14 | F2 | 106.6° | 109.5° |
| F | C14 | C13 | 112.1° | 109.5° |
| F1 | C14 | F2 | 106.7° | 109.4° |
| F1 | C14 | C13 | 112.3° | 109.5° |
| F2 | C14 | C13 | 112.3° | 109.5° |
| H261 | C26 | H262 | 109.4° | 109.5° |
| H261 | C26 | H263 | 109.4° | 109.4° |
| H262 | C26 | H263 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H251 | C25 | H253 | 109.4° | 109.5° |
| H252 | C25 | H253 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.4° | 109.5° |
| H241 | C24 | H243 | 109.5° | 109.5° |
| H242 | C24 | H243 | 109.5° | 109.5° |
| H211 | C21 | H212 | 109.5° | 109.5° |
| HC1 | C | HC2 | 109.4° | 109.4° |
| HC1 | C | HC3 | 109.5° | 109.5° |
| HC2 | C | HC3 | 109.5° | 109.5° |
| H61C | C6 | H62C | 109.4° | 109.4° |
| H91C | C9 | H92C | 109.4° | 109.5° |
| H91C | C9 | H93C | 109.5° | 109.5° |
| H92C | C9 | H93C | 109.5° | 109.5° |
| H81C | C8 | H82C | 109.5° | 109.5° |
| H81C | C8 | H83C | 109.4° | 109.4° |
| H82C | C8 | H83C | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.4° | 109.5° |
| H131 | C13 | C14 | 109.1° | 109.4° |
| H132 | C13 | C14 | 109.1° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C22 | C23 | N4 | 180.0° | 179.7° |
| O3 | C22 | C23 | C26 | 21.9° | 0.0° |
| O3 | C22 | C23 | C25 | 141.9° | 120.0° |
| O3 | C22 | C23 | C24 | 98.2° | 120.0° |
| O3 | C22 | N4 | C21 | 2.2° | 0.0° |
| O3 | C22 | N4 | H4 | 177.7° | 179.9° |
| C22 | C23 | C26 | C25 | 120.5° | 120.0° |
| C22 | C23 | C26 | C24 | 120.5° | 120.0° |
| C22 | C23 | C25 | C24 | 120.5° | 120.0° |
| C23 | C22 | N4 | C21 | 177.7° | 179.8° |
| C23 | C22 | N4 | H4 | 2.3° | 0.3° |
| C22 | C23 | C26 | H261 | 180.0° | 60.0° |
| C22 | C23 | C26 | H262 | 60.0° | 180.0° |
| C22 | C23 | C26 | H263 | 60.0° | 60.0° |
| C22 | C23 | C25 | H251 | 180.0° | 60.0° |
| C22 | C23 | C25 | H252 | 60.0° | 180.0° |
| C22 | C23 | C25 | H253 | 60.0° | 60.0° |
| C22 | C23 | C24 | H241 | 180.0° | 60.0° |
| C22 | C23 | C24 | H242 | 60.0° | 180.0° |
| C22 | C23 | C24 | H243 | 60.0° | 60.0° |
| N4 | C22 | C23 | C26 | 158.1° | 179.7° |
| N4 | C22 | C23 | C25 | 38.1° | 59.7° |
| N4 | C22 | C23 | C24 | 81.9° | 60.3° |
| C22 | N4 | C21 | H4 | 180.0° | 179.9° |
| C22 | N4 | C21 | C19 | 130.2° | 180.0° |
| C22 | N4 | C21 | H211 | 9.7° | 60.0° |
| C22 | N4 | C21 | H212 | 109.2° | 60.0° |
| C26 | C23 | C25 | C24 | 119.1° | 120.0° |
| C23 | C26 | H261 | H262 | 120.0° | 120.0° |
| C23 | C26 | H261 | H263 | 120.0° | 120.0° |
| C23 | C26 | H262 | H263 | 120.0° | 120.0° |
| C26 | C23 | C25 | H251 | 59.6° | 180.0° |
| C26 | C23 | C25 | H252 | 60.4° | 60.0° |
| C26 | C23 | C25 | H253 | 179.6° | 60.0° |
| C26 | C23 | C24 | H241 | 59.6° | 60.0° |
| C26 | C23 | C24 | H242 | 179.5° | 60.0° |
| C26 | C23 | C24 | H243 | 60.4° | 180.0° |
| C25 | C23 | C26 | H261 | 59.5° | 60.0° |
| C25 | C23 | C26 | H262 | 179.5° | 60.0° |
| C25 | C23 | C26 | H263 | 60.5° | 180.0° |
| C23 | C25 | H251 | H252 | 120.0° | 120.0° |
| C23 | C25 | H251 | H253 | 120.0° | 119.9° |
| C23 | C25 | H252 | H253 | 120.0° | 120.0° |
| C25 | C23 | C24 | H241 | 59.5° | 180.0° |
| C25 | C23 | C24 | H242 | 60.5° | 60.0° |
| C25 | C23 | C24 | H243 | 179.5° | 60.0° |
| C24 | C23 | C26 | H261 | 59.5° | 180.0° |
| C24 | C23 | C26 | H262 | 60.4° | 60.0° |
| C24 | C23 | C26 | H263 | 179.5° | 60.0° |
| C24 | C23 | C25 | H251 | 59.5° | 60.0° |
| C24 | C23 | C25 | H252 | 179.6° | 60.0° |
| C24 | C23 | C25 | H253 | 60.4° | 180.0° |
| C23 | C24 | H241 | H242 | 120.0° | 120.0° |
| C23 | C24 | H241 | H243 | 120.0° | 120.0° |
| C23 | C24 | H242 | H243 | 120.0° | 120.0° |
| N4 | C21 | C19 | H211 | 120.5° | 120.0° |
| N4 | C21 | C19 | H212 | 120.5° | 120.0° |
| N4 | C21 | C19 | C18 | 105.2° | 100.0° |
| N4 | C21 | C19 | C20 | 72.1° | 79.7° |
| N4 | C21 | H211 | H212 | 118.3° | 120.0° |
| C21 | C19 | C18 | C20 | 177.4° | 179.7° |
| C21 | C19 | C18 | C17 | 176.4° | 179.9° |
| C21 | C19 | C20 | CL1 | 5.1° | 0.0° |
| C21 | C19 | C20 | C15 | 175.9° | 179.7° |
| C19 | C21 | N4 | H4 | 49.8° | 0.0° |
| C19 | C21 | H211 | H212 | 118.4° | 120.0° |
| C21 | C19 | C18 | H18 | 3.6° | 0.1° |
| C19 | C18 | C17 | H18 | 180.0° | 179.9° |
| C19 | C18 | C17 | C16 | 0.1° | 0.1° |
| C18 | C19 | C20 | CL1 | 177.5° | 179.7° |
| C18 | C19 | C20 | C15 | 1.5° | 0.6° |
| C18 | C19 | C21 | H211 | 134.3° | 140.1° |
| C18 | C19 | C21 | H212 | 15.3° | 20.0° |
| C19 | C18 | C17 | H17 | 179.8° | 179.9° |
| C20 | C19 | C18 | C17 | 1.0° | 0.4° |
| C19 | C20 | C15 | C16 | 0.8° | 0.6° |
| C19 | C20 | CL1 | C15 | 179.1° | 179.7° |
| C19 | C20 | C15 | N3 | 178.9° | 179.7° |
| C20 | C19 | C21 | H211 | 48.4° | 40.3° |
| C20 | C19 | C21 | H212 | 167.4° | 160.3° |
| C20 | C19 | C18 | H18 | 179.0° | 179.8° |
| C18 | C17 | C16 | H17 | 180.0° | 180.0° |
| C18 | C17 | C16 | CL | 178.1° | 180.0° |
| C18 | C17 | C16 | C15 | 0.8° | 0.1° |
| C17 | C16 | CL | C15 | 179.0° | 180.0° |
| C17 | C16 | C15 | C20 | 0.3° | 0.3° |
| C17 | C16 | C15 | N3 | 179.9° | 180.0° |
| C16 | C17 | C18 | H18 | 179.9° | 180.0° |
| CL | C16 | C15 | C20 | 178.6° | 179.7° |
| CL | C16 | C15 | N3 | 1.2° | 0.0° |
| CL | C16 | C17 | H17 | 1.9° | 0.1° |
| C16 | C15 | C20 | CL1 | 178.2° | 179.7° |
| C16 | C15 | C20 | N3 | 179.8° | 179.7° |
| C16 | C15 | N3 | C1 | 119.0° | 90.6° |
| C15 | C16 | C17 | H17 | 179.2° | 179.9° |
| C16 | C15 | N3 | H3 | 61.0° | 89.4° |
| CL1 | C20 | C15 | N3 | 2.1° | 0.0° |
| C20 | C15 | N3 | C1 | 60.7° | 89.6° |
| C20 | C15 | N3 | H3 | 119.3° | 90.3° |
| C15 | N3 | C1 | H3 | 180.0° | 179.9° |
| C15 | N3 | C1 | N1 | 2.1° | 5.2° |
| C15 | N3 | C1 | N | 178.2° | 175.3° |
| N3 | C1 | N1 | N | 179.7° | 179.6° |
| N3 | C1 | N1 | C2 | 179.7° | 180.0° |
| N3 | C1 | N | C11 | 179.9° | 179.9° |
| N3 | C1 | N | C | 0.2° | 0.1° |
| C1 | N1 | C2 | C11 | 0.2° | 0.1° |
| C1 | N1 | C2 | C3 | 179.5° | 180.0° |
| N1 | C1 | N | C11 | 0.1° | 0.5° |
| N1 | C1 | N | C | 179.5° | 179.7° |
| N1 | C1 | N3 | H3 | 177.9° | 174.9° |
| N | C1 | N1 | C2 | 0.0° | 0.3° |
| C1 | N | C11 | C2 | 0.2° | 0.4° |
| C1 | N | C11 | C | 179.7° | 179.8° |
| C1 | N | C11 | C10 | 179.8° | 179.8° |
| N | C1 | N3 | H3 | 1.8° | 4.7° |
| C1 | N | C | HC1 | 180.0° | 90.0° |
| C1 | N | C | HC2 | 60.0° | 150.0° |
| C1 | N | C | HC3 | 60.0° | 30.0° |
| N1 | C2 | C11 | C3 | 179.8° | 179.9° |
| N1 | C2 | C11 | N | 0.2° | 0.2° |
| N1 | C2 | C11 | C10 | 179.7° | 180.0° |
| N1 | C2 | C3 | C4 | 179.7° | 180.0° |
| N1 | C2 | C3 | HA | 0.3° | 0.1° |
| C2 | C11 | N | C10 | 180.0° | 179.8° |
| C2 | C11 | N | C | 179.5° | 179.8° |
| C2 | C11 | C10 | C5 | 0.3° | 0.1° |
| C11 | C2 | C3 | C4 | 0.0° | 0.1° |
| C11 | C2 | C3 | HA | 180.0° | 180.0° |
| C2 | C11 | C10 | H10 | 179.7° | 180.0° |
| C3 | C2 | C11 | N | 179.5° | 179.7° |
| C3 | C2 | C11 | C10 | 0.5° | 0.1° |
| C2 | C3 | C4 | C5 | 0.7° | 0.1° |
| C2 | C3 | C4 | HA | 180.0° | 180.0° |
| C2 | C3 | C4 | C12 | 177.5° | 180.0° |
| N | C11 | C10 | C5 | 179.8° | 179.7° |
| N | C11 | C10 | H10 | 0.3° | 0.2° |
| C11 | N | C | HC1 | 0.4° | 89.7° |
| C11 | N | C | HC2 | 119.6° | 30.2° |
| C11 | N | C | HC3 | 120.4° | 150.2° |
| C10 | C11 | N | C | 0.6° | 0.0° |
| C11 | C10 | C5 | H10 | 180.0° | 179.9° |
| C11 | C10 | C5 | O | 178.6° | 180.0° |
| C11 | C10 | C5 | C4 | 0.5° | 0.1° |
| N | C | HC1 | HC2 | 120.0° | 120.0° |
| N | C | HC1 | HC3 | 120.0° | 120.0° |
| N | C | HC2 | HC3 | 120.0° | 120.0° |
| C10 | C5 | O | C4 | 179.2° | 180.0° |
| C10 | C5 | O | C6 | 28.6° | 0.0° |
| C10 | C5 | C4 | C3 | 1.0° | 0.1° |
| C10 | C5 | C4 | C12 | 177.1° | 180.0° |
| C5 | O | C6 | C7 | 163.7° | 180.0° |
| O | C5 | C4 | C3 | 178.2° | 180.0° |
| O | C5 | C4 | C12 | 3.7° | 0.0° |
| O | C5 | C10 | H10 | 1.3° | 0.1° |
| C5 | O | C6 | H61C | 77.5° | 60.0° |
| C5 | O | C6 | H62C | 44.9° | 60.0° |
| C4 | C5 | O | C6 | 152.2° | 180.0° |
| C5 | C4 | C3 | C12 | 178.3° | 180.0° |
| C5 | C4 | C12 | O2 | 164.9° | 0.0° |
| C5 | C4 | C12 | N2 | 15.7° | 180.0° |
| C5 | C4 | C3 | HA | 179.3° | 180.0° |
| C4 | C5 | C10 | H10 | 179.5° | 180.0° |
| O | C6 | C7 | H61C | 118.8° | 120.0° |
| O | C6 | C7 | H62C | 118.8° | 120.0° |
| O | C6 | C7 | O1 | 70.1° | 60.0° |
| O | C6 | C7 | C9 | 48.0° | 60.0° |
| O | C6 | C7 | C8 | 170.2° | 180.0° |
| O | C6 | H61C | H62C | 123.5° | 120.0° |
| C6 | C7 | O1 | C9 | 118.5° | 119.9° |
| C6 | C7 | O1 | C8 | 121.9° | 120.1° |
| C6 | C7 | C9 | C8 | 122.6° | 120.0° |
| C7 | C6 | H61C | H62C | 123.4° | 120.0° |
| C6 | C7 | O1 | H1 | 180.0° | 60.0° |
| C6 | C7 | C9 | H91C | 180.0° | 60.0° |
| C6 | C7 | C9 | H92C | 60.0° | 180.0° |
| C6 | C7 | C9 | H93C | 60.0° | 60.0° |
| C6 | C7 | C8 | H81C | 180.0° | 60.0° |
| C6 | C7 | C8 | H82C | 60.0° | 179.9° |
| C6 | C7 | C8 | H83C | 60.0° | 60.0° |
| O1 | C7 | C9 | C8 | 117.6° | 120.0° |
| O1 | C7 | C6 | H61C | 48.8° | 180.0° |
| O1 | C7 | C6 | H62C | 171.1° | 60.0° |
| O1 | C7 | C9 | H91C | 60.2° | 180.0° |
| O1 | C7 | C9 | H92C | 179.8° | 60.0° |
| O1 | C7 | C9 | H93C | 59.8° | 60.0° |
| O1 | C7 | C8 | H81C | 58.6° | 60.0° |
| O1 | C7 | C8 | H82C | 61.4° | 60.0° |
| O1 | C7 | C8 | H83C | 178.6° | 180.0° |
| C9 | C7 | C6 | H61C | 166.8° | 60.0° |
| C9 | C7 | C6 | H62C | 70.8° | 180.0° |
| C9 | C7 | O1 | H1 | 61.5° | 180.0° |
| C7 | C9 | H91C | H92C | 120.0° | 120.0° |
| C7 | C9 | H91C | H93C | 120.0° | 120.0° |
| C7 | C9 | H92C | H93C | 120.0° | 120.0° |
| C9 | C7 | C8 | H81C | 59.1° | 180.0° |
| C9 | C7 | C8 | H82C | 179.1° | 60.0° |
| C9 | C7 | C8 | H83C | 60.9° | 60.0° |
| C8 | C7 | C6 | H61C | 71.0° | 60.0° |
| C8 | C7 | C6 | H62C | 51.4° | 60.0° |
| C8 | C7 | O1 | H1 | 58.1° | 60.0° |
| C8 | C7 | C9 | H91C | 57.4° | 60.0° |
| C8 | C7 | C9 | H92C | 62.6° | 60.0° |
| C8 | C7 | C9 | H93C | 177.4° | 180.0° |
| C7 | C8 | H81C | H82C | 120.0° | 120.1° |
| C7 | C8 | H81C | H83C | 120.0° | 120.0° |
| C7 | C8 | H82C | H83C | 120.0° | 120.0° |
| C3 | C4 | C12 | O2 | 16.9° | 180.0° |
| C3 | C4 | C12 | N2 | 162.4° | 0.0° |
| C4 | C12 | O2 | N2 | 179.3° | 180.0° |
| C4 | C12 | N2 | C13 | 175.4° | 180.0° |
| C12 | C4 | C3 | HA | 2.4° | 0.0° |
| C4 | C12 | N2 | H2 | 4.6° | 0.0° |
| O2 | C12 | N2 | C13 | 3.9° | 0.0° |
| O2 | C12 | N2 | H2 | 176.0° | 180.0° |
| C12 | N2 | C13 | H2 | 180.0° | 180.0° |
| C12 | N2 | C13 | H131 | 41.1° | 60.0° |
| C12 | N2 | C13 | H132 | 160.6° | 60.1° |
| C12 | N2 | C13 | C14 | 79.2° | 180.0° |
| N2 | C13 | C14 | F | 174.6° | 60.1° |
| N2 | C13 | C14 | F1 | 54.6° | 180.0° |
| N2 | C13 | C14 | F2 | 65.6° | 60.0° |
| N2 | C13 | H131 | H132 | 119.3° | 120.1° |
| N2 | C13 | H131 | C14 | 121.4° | 120.0° |
| N2 | C13 | H132 | C14 | 121.4° | 120.0° |
| F | C14 | F1 | F2 | 113.6° | 120.0° |
| F | C14 | F1 | C13 | 123.1° | 120.0° |
| F | C14 | F2 | C13 | 123.0° | 120.0° |
| F | C14 | C13 | H131 | 54.3° | 60.0° |
| F | C14 | C13 | H132 | 65.2° | 179.9° |
| F1 | C14 | F2 | C13 | 123.4° | 120.0° |
| F1 | C14 | C13 | H131 | 65.6° | 60.0° |
| F1 | C14 | C13 | H132 | 174.8° | 60.0° |
| F2 | C14 | C13 | H131 | 174.2° | 180.0° |
| F2 | C14 | C13 | H132 | 54.7° | 60.0° |
| H4 | N4 | C21 | H211 | 170.3° | 120.0° |
| H4 | N4 | C21 | H212 | 70.7° | 119.9° |
| H261 | C26 | H262 | H263 | 119.9° | 120.0° |
| H251 | C25 | H252 | H253 | 120.0° | 120.0° |
| H241 | C24 | H242 | H243 | 120.0° | 120.0° |
| H18 | C18 | C17 | H17 | 0.1° | 0.0° |
| HC1 | C | HC2 | HC3 | 120.0° | 120.0° |
| H91C | C9 | H92C | H93C | 120.0° | 120.0° |
| H81C | C8 | H82C | H83C | 119.9° | 120.0° |
| H2 | N2 | C13 | H131 | 139.0° | 120.0° |
| H2 | N2 | C13 | H132 | 19.5° | 120.0° |
| H2 | N2 | C13 | C14 | 100.8° | 0.0° |
| H131 | C13 | H132 | C14 | 119.3° | 119.9° |
