4QF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F18 | C16 | sing | 1.35Å | 1.35Å | |
| O11 | C9 | doub | 1.22Å | 1.23Å | |
| C16 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C12 | doub | 1.39Å | 1.38Å | Aromatic |
| C9 | N8 | sing | 1.34Å | 1.36Å | |
| C9 | N10 | sing | 1.35Å | 1.39Å | |
| C14 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | N10 | sing | 1.40Å | 1.42Å | |
| N8 | C7 | doub | 1.31Å | 1.30Å | |
| N10 | C6 | sing | 1.47Å | 1.46Å | |
| C7 | C6 | sing | 1.51Å | 1.52Å | |
| C7 | N19 | sing | 1.35Å | 1.39Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C25 | C20 | sing | 1.53Å | 1.52Å | |
| C29 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C6 | C1 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C20 | N19 | sing | 1.46Å | 1.46Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C28 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C33 | sing | 1.53Å | 1.52Å | |
| C4 | N3 | sing | 1.47Å | 1.50Å | |
| C23 | C22 | sing | 1.53Å | 1.52Å | |
| C31 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| C2 | N3 | sing | 1.47Å | 1.51Å | |
| C27 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C26 | sing | 1.51Å | 1.51Å | |
| N3 | C26 | sing | 1.47Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.08Å | 1.08Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| N19 | H18 | sing | 0.97Å | 1.00Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C24 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C28 | H27 | sing | 1.08Å | 1.08Å | |
| C29 | H28 | sing | 1.08Å | 1.08Å | |
| C30 | H29 | sing | 1.08Å | 1.08Å | |
| C31 | H30 | sing | 1.08Å | 1.08Å | |
| C32 | H31 | sing | 1.08Å | 1.08Å | |
| C33 | H32 | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F18 | C16 | C15 | 120.1° | 120.0° |
| F18 | C16 | C17 | 119.0° | 120.0° |
| O11 | C9 | N8 | 123.7° | 123.9° |
| O11 | C9 | N10 | 127.7° | 124.0° |
| C15 | C16 | C17 | 120.9° | 120.0° |
| C16 | C15 | C14 | 118.9° | 120.1° |
| C16 | C15 | H10 | 120.6° | 120.0° |
| C16 | C17 | C12 | 120.2° | 119.9° |
| C16 | C17 | H11 | 119.9° | 120.0° |
| C15 | C14 | C13 | 120.6° | 120.1° |
| C15 | C14 | H9 | 119.7° | 119.9° |
| C14 | C15 | H10 | 120.6° | 119.9° |
| C17 | C12 | C13 | 119.2° | 119.8° |
| C17 | C12 | N10 | 119.7° | 120.1° |
| C12 | C17 | H11 | 119.9° | 120.1° |
| N8 | C9 | N10 | 108.6° | 112.1° |
| C9 | N8 | C7 | 108.3° | 112.5° |
| C9 | N10 | C12 | 120.0° | 127.2° |
| C9 | N10 | C6 | 112.5° | 105.7° |
| C14 | C13 | C12 | 120.2° | 120.0° |
| C14 | C13 | H8 | 119.9° | 120.0° |
| C13 | C14 | H9 | 119.7° | 120.0° |
| C13 | C12 | N10 | 121.0° | 120.1° |
| C12 | C13 | H8 | 119.9° | 120.0° |
| C12 | N10 | C6 | 127.4° | 127.2° |
| N8 | C7 | C6 | 114.8° | 105.9° |
| N8 | C7 | N19 | 125.0° | 127.1° |
| N10 | C6 | C7 | 95.7° | 103.9° |
| N10 | C6 | C5 | 115.3° | 110.5° |
| N10 | C6 | C1 | 113.9° | 110.6° |
| C6 | C7 | N19 | 120.2° | 127.0° |
| C7 | C6 | C5 | 108.5° | 110.6° |
| C7 | C6 | C1 | 109.1° | 110.5° |
| C7 | N19 | C20 | 121.9° | 120.0° |
| C7 | N19 | H18 | 119.1° | 120.0° |
| C25 | C24 | C23 | 111.5° | 109.5° |
| C24 | C25 | C20 | 110.4° | 109.5° |
| C25 | C24 | H21 | 109.0° | 109.5° |
| C25 | C24 | H22 | 109.0° | 109.5° |
| C24 | C25 | H23 | 109.2° | 109.5° |
| C24 | C25 | H24 | 109.2° | 109.5° |
| C24 | C23 | C22 | 110.8° | 109.5° |
| C24 | C23 | H19 | 109.1° | 109.5° |
| C24 | C23 | H20 | 109.2° | 109.5° |
| C23 | C24 | H21 | 109.0° | 109.5° |
| C23 | C24 | H22 | 109.0° | 109.5° |
| C25 | C20 | N19 | 110.3° | 109.5° |
| C25 | C20 | C21 | 110.6° | 109.4° |
| C25 | C20 | H12 | 108.0° | 109.5° |
| C20 | C25 | H23 | 109.2° | 109.5° |
| C20 | C25 | H24 | 109.2° | 109.5° |
| C30 | C29 | C28 | 119.2° | 120.0° |
| C29 | C30 | C31 | 120.6° | 120.0° |
| C30 | C29 | H28 | 120.4° | 120.0° |
| C29 | C30 | H29 | 119.7° | 120.0° |
| C29 | C28 | C27 | 120.9° | 120.0° |
| C29 | C28 | H27 | 119.6° | 120.0° |
| C28 | C29 | H28 | 120.4° | 120.0° |
| C5 | C6 | C1 | 112.8° | 110.6° |
| C6 | C5 | C4 | 113.0° | 109.3° |
| C6 | C5 | H6 | 108.6° | 109.5° |
| C6 | C5 | H7 | 108.6° | 109.5° |
| C6 | C1 | C2 | 112.7° | 109.3° |
| C6 | C1 | H1 | 108.6° | 109.5° |
| C6 | C1 | H2 | 108.6° | 109.5° |
| C30 | C31 | C32 | 119.5° | 120.0° |
| C31 | C30 | H29 | 119.7° | 120.0° |
| C30 | C31 | H30 | 120.2° | 120.0° |
| C5 | C4 | C33 | 110.4° | 109.5° |
| C5 | C4 | N3 | 111.0° | 109.4° |
| C5 | C4 | H5 | 107.9° | 109.5° |
| C4 | C5 | H6 | 108.6° | 109.5° |
| C4 | C5 | H7 | 108.6° | 109.5° |
| N19 | C20 | C21 | 110.8° | 109.4° |
| N19 | C20 | H12 | 108.9° | 109.5° |
| C20 | N19 | H18 | 119.0° | 120.1° |
| C20 | C21 | C22 | 111.1° | 109.5° |
| C21 | C20 | H12 | 108.0° | 109.5° |
| C20 | C21 | H13 | 109.1° | 109.5° |
| C20 | C21 | H14 | 109.1° | 109.4° |
| C28 | C27 | C32 | 119.2° | 120.0° |
| C28 | C27 | C26 | 120.5° | 120.0° |
| C27 | C28 | H27 | 119.5° | 120.0° |
| C33 | C4 | N3 | 111.4° | 109.5° |
| C33 | C4 | H5 | 107.9° | 109.5° |
| C4 | C33 | H32 | 109.5° | 109.5° |
| C4 | C33 | H33 | 109.5° | 109.5° |
| C4 | C33 | H34 | 109.4° | 109.5° |
| C4 | N3 | C2 | 115.8° | 111.3° |
| C4 | N3 | C26 | 115.1° | 111.0° |
| N3 | C4 | H5 | 108.1° | 109.4° |
| C23 | C22 | C21 | 111.3° | 109.5° |
| C23 | C22 | H15 | 109.0° | 109.5° |
| C23 | C22 | H16 | 109.0° | 109.5° |
| C22 | C23 | H19 | 109.1° | 109.4° |
| C22 | C23 | H20 | 109.1° | 109.5° |
| C31 | C32 | C27 | 120.5° | 120.0° |
| C32 | C31 | H30 | 120.2° | 120.0° |
| C31 | C32 | H31 | 119.8° | 120.0° |
| C1 | C2 | N3 | 114.2° | 109.5° |
| C2 | C1 | H1 | 108.7° | 109.5° |
| C2 | C1 | H2 | 108.7° | 109.5° |
| C1 | C2 | H3 | 108.2° | 109.4° |
| C1 | C2 | H4 | 108.3° | 109.5° |
| C22 | C21 | H13 | 109.0° | 109.4° |
| C22 | C21 | H14 | 109.1° | 109.5° |
| C21 | C22 | H15 | 109.0° | 109.5° |
| C21 | C22 | H16 | 109.0° | 109.5° |
| C2 | N3 | C26 | 112.0° | 111.0° |
| N3 | C2 | H3 | 108.3° | 109.5° |
| N3 | C2 | H4 | 108.3° | 109.5° |
| C32 | C27 | C26 | 120.4° | 120.0° |
| C27 | C32 | H31 | 119.7° | 120.0° |
| C27 | C26 | N3 | 115.8° | 109.4° |
| C27 | C26 | H25 | 107.9° | 109.5° |
| C27 | C26 | H26 | 107.9° | 109.5° |
| N3 | C26 | H25 | 107.9° | 109.4° |
| N3 | C26 | H26 | 107.9° | 109.4° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H3 | C2 | H4 | 109.5° | 109.5° |
| H6 | C5 | H7 | 109.5° | 109.5° |
| H13 | C21 | H14 | 109.5° | 109.5° |
| H15 | C22 | H16 | 109.5° | 109.4° |
| H19 | C23 | H20 | 109.5° | 109.4° |
| H21 | C24 | H22 | 109.5° | 109.5° |
| H23 | C25 | H24 | 109.5° | 109.4° |
| H25 | C26 | H26 | 109.5° | 109.5° |
| H32 | C33 | H33 | 109.4° | 109.5° |
| H32 | C33 | H34 | 109.5° | 109.4° |
| H33 | C33 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F18 | C16 | C15 | C17 | 178.6° | 179.8° |
| F18 | C16 | C15 | C14 | 178.8° | 180.0° |
| F18 | C16 | C17 | C12 | 179.5° | 179.7° |
| F18 | C16 | C15 | H10 | 1.2° | 0.1° |
| F18 | C16 | C17 | H11 | 0.4° | 0.2° |
| O11 | C9 | N8 | N10 | 179.5° | 179.9° |
| O11 | C9 | N10 | C12 | 1.2° | 0.2° |
| O11 | C9 | N8 | C7 | 177.9° | 180.0° |
| O11 | C9 | N10 | C6 | 177.3° | 179.9° |
| C16 | C15 | C14 | H10 | 180.0° | 180.0° |
| C15 | C16 | C17 | C12 | 1.0° | 0.4° |
| C16 | C15 | C14 | C13 | 0.7° | 0.0° |
| C16 | C15 | C14 | H9 | 179.3° | 180.0° |
| C15 | C16 | C17 | H11 | 179.0° | 180.0° |
| C17 | C16 | C15 | C14 | 0.3° | 0.2° |
| C16 | C17 | C12 | H11 | 180.0° | 179.5° |
| C16 | C17 | C12 | C13 | 2.1° | 0.5° |
| C16 | C17 | C12 | N10 | 178.4° | 179.8° |
| C17 | C16 | C15 | H10 | 179.7° | 179.8° |
| C15 | C14 | C13 | H9 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 1.9° | 0.0° |
| C15 | C14 | C13 | H8 | 178.1° | 180.0° |
| C17 | C12 | N10 | C9 | 81.7° | 0.3° |
| C17 | C12 | C13 | C14 | 2.6° | 0.2° |
| C17 | C12 | C13 | N10 | 176.2° | 179.7° |
| C17 | C12 | N10 | C6 | 96.5° | 179.8° |
| C17 | C12 | C13 | H8 | 177.4° | 179.8° |
| N8 | C9 | N10 | C12 | 179.3° | 179.9° |
| N8 | C9 | N10 | C6 | 2.2° | 0.0° |
| C9 | N8 | C7 | C6 | 0.6° | 0.1° |
| C9 | N8 | C7 | N19 | 179.4° | 180.0° |
| C9 | N10 | C12 | C13 | 94.5° | 180.0° |
| C9 | N10 | C12 | C6 | 178.2° | 179.9° |
| N10 | C9 | N8 | C7 | 1.7° | 0.1° |
| C9 | N10 | C6 | C7 | 1.7° | 0.0° |
| C9 | N10 | C6 | C5 | 111.8° | 118.7° |
| C9 | N10 | C6 | C1 | 115.5° | 118.6° |
| C14 | C13 | C12 | H8 | 180.0° | 180.0° |
| C14 | C13 | C12 | N10 | 178.8° | 180.0° |
| C13 | C14 | C15 | H10 | 179.3° | 180.0° |
| C13 | C12 | N10 | C6 | 87.3° | 0.1° |
| C12 | C13 | C14 | H9 | 178.1° | 180.0° |
| C13 | C12 | C17 | H11 | 177.9° | 180.0° |
| C12 | N10 | C6 | C7 | 180.0° | 179.9° |
| C12 | N10 | C6 | C5 | 66.5° | 61.4° |
| C12 | N10 | C6 | C1 | 66.2° | 61.3° |
| N10 | C12 | C13 | H8 | 1.2° | 0.0° |
| N10 | C12 | C17 | H11 | 1.6° | 0.3° |
| N8 | C7 | C6 | N10 | 0.7° | 0.0° |
| N8 | C7 | C6 | N19 | 178.9° | 179.9° |
| N8 | C7 | C6 | C5 | 118.4° | 118.6° |
| N8 | C7 | C6 | C1 | 118.3° | 118.6° |
| N8 | C7 | N19 | C20 | 0.9° | 0.1° |
| N8 | C7 | N19 | H18 | 179.1° | 179.9° |
| N10 | C6 | C7 | C5 | 119.0° | 118.6° |
| N10 | C6 | C7 | C1 | 117.7° | 118.6° |
| N10 | C6 | C7 | N19 | 178.2° | 179.9° |
| N10 | C6 | C5 | C1 | 133.2° | 122.7° |
| N10 | C6 | C5 | C4 | 80.2° | 66.5° |
| N10 | C6 | C1 | C2 | 85.5° | 66.5° |
| N10 | C6 | C1 | H1 | 35.0° | 173.6° |
| N10 | C6 | C1 | H2 | 154.0° | 53.5° |
| N10 | C6 | C5 | H6 | 159.2° | 53.5° |
| N10 | C6 | C5 | H7 | 40.3° | 173.6° |
| C7 | C6 | C5 | C1 | 121.0° | 122.8° |
| C7 | C6 | C5 | C4 | 173.9° | 179.0° |
| C6 | C7 | N19 | C20 | 179.7° | 180.0° |
| C7 | C6 | C1 | C2 | 169.1° | 179.0° |
| C7 | C6 | C1 | H1 | 70.5° | 59.1° |
| C7 | C6 | C1 | H2 | 48.6° | 61.0° |
| C7 | C6 | C5 | H6 | 53.4° | 61.0° |
| C7 | C6 | C5 | H7 | 65.5° | 59.1° |
| C6 | C7 | N19 | H18 | 0.3° | 0.0° |
| C7 | N19 | C20 | C25 | 94.7° | 85.0° |
| N19 | C7 | C6 | C5 | 62.8° | 61.3° |
| N19 | C7 | C6 | C1 | 60.5° | 61.5° |
| C7 | N19 | C20 | H18 | 180.0° | 180.0° |
| C7 | N19 | C20 | C21 | 142.4° | 155.0° |
| C7 | N19 | C20 | H12 | 23.7° | 35.0° |
| C25 | C24 | C23 | H21 | 120.3° | 120.0° |
| C25 | C24 | C23 | H22 | 120.3° | 120.0° |
| C24 | C25 | C20 | H23 | 120.2° | 120.0° |
| C24 | C25 | C20 | H24 | 120.1° | 120.1° |
| C24 | C25 | C20 | N19 | 179.8° | 180.0° |
| C24 | C25 | C20 | C21 | 57.1° | 60.0° |
| C25 | C24 | C23 | C22 | 55.7° | 60.0° |
| C24 | C25 | C20 | H12 | 60.9° | 60.0° |
| C25 | C24 | C23 | H19 | 175.9° | 60.0° |
| C25 | C24 | C23 | H20 | 64.5° | 180.0° |
| C25 | C24 | H21 | H22 | 119.1° | 120.0° |
| C24 | C25 | H23 | H24 | 119.6° | 120.0° |
| C23 | C24 | C25 | C20 | 56.9° | 60.0° |
| C24 | C23 | C22 | H19 | 120.2° | 120.0° |
| C24 | C23 | C22 | H20 | 120.2° | 120.1° |
| C24 | C23 | C22 | C21 | 54.9° | 60.0° |
| C24 | C23 | C22 | H15 | 65.4° | 180.0° |
| C24 | C23 | C22 | H16 | 175.1° | 60.1° |
| C24 | C23 | H19 | H20 | 119.4° | 120.0° |
| C23 | C24 | H21 | H22 | 119.1° | 120.0° |
| C23 | C24 | C25 | H23 | 63.2° | 180.0° |
| C23 | C24 | C25 | H24 | 177.1° | 60.0° |
| C25 | C20 | N19 | C21 | 122.9° | 119.9° |
| C25 | C20 | N19 | H12 | 118.4° | 120.0° |
| C25 | C20 | C21 | H12 | 118.0° | 120.0° |
| C25 | C20 | C21 | C22 | 56.8° | 60.0° |
| C25 | C20 | C21 | H13 | 63.4° | 60.0° |
| C25 | C20 | C21 | H14 | 177.1° | 180.0° |
| C25 | C20 | N19 | H18 | 85.3° | 95.0° |
| C20 | C25 | C24 | H21 | 63.4° | 180.0° |
| C20 | C25 | C24 | H22 | 177.2° | 60.0° |
| C20 | C25 | H23 | H24 | 119.6° | 120.0° |
| C30 | C29 | C28 | H28 | 180.0° | 180.0° |
| C29 | C30 | C31 | H29 | 180.0° | 180.0° |
| C30 | C29 | C28 | C27 | 1.1° | 0.0° |
| C29 | C30 | C31 | C32 | 0.4° | 0.0° |
| C30 | C29 | C28 | H27 | 178.9° | 180.0° |
| C29 | C30 | C31 | H30 | 179.6° | 179.9° |
| C28 | C29 | C30 | C31 | 1.5° | 0.0° |
| C29 | C28 | C27 | H27 | 180.0° | 179.9° |
| C29 | C28 | C27 | C32 | 0.4° | 0.0° |
| C29 | C28 | C27 | C26 | 179.5° | 179.8° |
| C28 | C29 | C30 | H29 | 178.5° | 180.0° |
| C6 | C5 | C4 | H6 | 120.6° | 119.9° |
| C6 | C5 | C4 | H7 | 120.5° | 119.9° |
| C6 | C5 | C4 | C33 | 176.2° | 178.2° |
| C6 | C5 | C4 | N3 | 52.2° | 58.2° |
| C5 | C6 | C1 | C2 | 48.4° | 56.2° |
| C5 | C6 | C1 | H1 | 168.9° | 63.7° |
| C5 | C6 | C1 | H2 | 72.1° | 176.2° |
| C6 | C5 | C4 | H5 | 66.1° | 61.7° |
| C6 | C5 | H6 | H7 | 118.4° | 120.1° |
| C1 | C6 | C5 | C4 | 53.0° | 56.3° |
| C6 | C1 | C2 | H1 | 120.5° | 120.0° |
| C6 | C1 | C2 | H2 | 120.5° | 120.0° |
| C6 | C1 | C2 | N3 | 44.9° | 58.2° |
| C6 | C1 | H1 | H2 | 118.5° | 120.1° |
| C6 | C1 | C2 | H3 | 75.8° | 61.8° |
| C6 | C1 | C2 | H4 | 165.7° | 178.2° |
| C1 | C6 | C5 | H6 | 67.6° | 176.2° |
| C1 | C6 | C5 | H7 | 173.5° | 63.7° |
| C30 | C31 | C32 | H30 | 180.0° | 180.0° |
| C30 | C31 | C32 | C27 | 1.1° | 0.0° |
| C31 | C30 | C29 | H28 | 178.6° | 180.0° |
| C30 | C31 | C32 | H31 | 178.9° | 179.8° |
| C5 | C4 | C33 | N3 | 123.8° | 120.0° |
| C5 | C4 | C33 | H5 | 117.7° | 120.0° |
| C5 | C4 | N3 | H5 | 118.2° | 120.0° |
| C5 | C4 | N3 | C2 | 49.4° | 62.2° |
| C5 | C4 | N3 | C26 | 177.3° | 173.6° |
| C4 | C5 | H6 | H7 | 118.3° | 120.1° |
| C5 | C4 | C33 | H32 | 180.0° | 67.7° |
| C5 | C4 | C33 | H33 | 60.0° | 52.3° |
| C5 | C4 | C33 | H34 | 60.0° | 172.3° |
| N19 | C20 | C21 | H12 | 119.2° | 120.1° |
| N19 | C20 | C21 | C22 | 179.5° | 180.0° |
| N19 | C20 | C21 | H13 | 59.3° | 60.0° |
| N19 | C20 | C21 | H14 | 60.2° | 60.1° |
| N19 | C20 | C25 | H23 | 60.0° | 60.0° |
| N19 | C20 | C25 | H24 | 59.7° | 59.9° |
| C20 | C21 | C22 | C23 | 55.7° | 60.0° |
| C20 | C21 | C22 | H13 | 120.2° | 120.0° |
| C20 | C21 | C22 | H14 | 120.3° | 120.0° |
| C20 | C21 | H13 | H14 | 119.3° | 120.0° |
| C20 | C21 | C22 | H15 | 64.6° | 179.9° |
| C20 | C21 | C22 | H16 | 176.0° | 60.0° |
| C21 | C20 | N19 | H18 | 37.6° | 25.0° |
| C21 | C20 | C25 | H23 | 63.0° | 180.0° |
| C21 | C20 | C25 | H24 | 177.3° | 60.0° |
| C28 | C27 | C32 | C31 | 1.5° | 0.0° |
| C28 | C27 | C32 | C26 | 179.9° | 179.8° |
| C28 | C27 | C26 | N3 | 86.7° | 89.8° |
| C28 | C27 | C26 | H25 | 34.2° | 150.3° |
| C28 | C27 | C26 | H26 | 152.4° | 30.2° |
| C27 | C28 | C29 | H28 | 178.9° | 180.0° |
| C28 | C27 | C32 | H31 | 178.5° | 179.8° |
| C33 | C4 | N3 | H5 | 118.4° | 120.0° |
| C33 | C4 | N3 | C2 | 172.9° | 177.8° |
| C33 | C4 | N3 | C26 | 53.9° | 53.6° |
| C33 | C4 | C5 | H6 | 55.7° | 61.9° |
| C33 | C4 | C5 | H7 | 63.2° | 58.3° |
| C4 | C33 | H32 | H33 | 120.0° | 120.0° |
| C4 | C33 | H32 | H34 | 120.0° | 120.0° |
| C4 | C33 | H33 | H34 | 120.0° | 120.0° |
| C4 | N3 | C2 | C1 | 46.6° | 62.2° |
| C4 | N3 | C2 | C26 | 134.7° | 124.2° |
| C4 | N3 | C26 | C27 | 73.3° | 159.6° |
| C4 | N3 | C2 | H3 | 74.1° | 57.8° |
| C4 | N3 | C2 | H4 | 167.3° | 177.8° |
| N3 | C4 | C5 | H6 | 68.3° | 178.2° |
| N3 | C4 | C5 | H7 | 172.7° | 61.7° |
| C4 | N3 | C26 | H25 | 47.7° | 39.7° |
| C4 | N3 | C26 | H26 | 165.8° | 80.4° |
| N3 | C4 | C33 | H32 | 56.2° | 52.3° |
| N3 | C4 | C33 | H33 | 63.8° | 172.3° |
| N3 | C4 | C33 | H34 | 176.2° | 67.7° |
| C23 | C22 | C21 | H15 | 120.3° | 120.1° |
| C23 | C22 | C21 | H16 | 120.3° | 120.0° |
| C23 | C22 | C21 | H13 | 64.5° | 60.0° |
| C23 | C22 | C21 | H14 | 176.0° | 180.0° |
| C23 | C22 | H15 | H16 | 119.2° | 120.0° |
| C22 | C23 | H19 | H20 | 119.4° | 120.0° |
| C22 | C23 | C24 | H21 | 64.6° | 180.0° |
| C22 | C23 | C24 | H22 | 176.0° | 60.1° |
| C31 | C32 | C27 | H31 | 180.0° | 179.7° |
| C31 | C32 | C27 | C26 | 178.4° | 179.8° |
| C32 | C31 | C30 | H29 | 179.6° | 180.0° |
| C1 | C2 | N3 | H3 | 120.7° | 120.0° |
| C1 | C2 | N3 | H4 | 120.7° | 120.0° |
| C1 | C2 | N3 | C26 | 178.7° | 173.6° |
| C2 | C1 | H1 | H2 | 118.5° | 120.1° |
| C1 | C2 | H3 | H4 | 117.8° | 120.0° |
| C22 | C21 | C20 | H12 | 61.2° | 60.0° |
| C22 | C21 | H13 | H14 | 119.3° | 120.0° |
| C21 | C22 | H15 | H16 | 119.2° | 120.0° |
| C21 | C22 | C23 | H19 | 175.0° | 60.0° |
| C21 | C22 | C23 | H20 | 65.4° | 179.9° |
| C2 | N3 | C26 | C27 | 61.8° | 76.0° |
| N3 | C2 | C1 | H1 | 165.4° | 61.7° |
| N3 | C2 | C1 | H2 | 75.6° | 178.2° |
| N3 | C2 | H3 | H4 | 117.9° | 120.0° |
| C2 | N3 | C4 | H5 | 68.8° | 57.8° |
| C2 | N3 | C26 | H25 | 177.3° | 164.1° |
| C2 | N3 | C26 | H26 | 59.1° | 44.0° |
| C32 | C27 | C26 | N3 | 93.1° | 90.0° |
| C32 | C27 | C26 | H25 | 146.0° | 29.9° |
| C32 | C27 | C26 | H26 | 27.8° | 150.0° |
| C32 | C27 | C28 | H27 | 179.6° | 180.0° |
| C27 | C32 | C31 | H30 | 178.9° | 179.9° |
| C27 | C26 | N3 | H25 | 120.9° | 119.9° |
| C27 | C26 | N3 | H26 | 120.9° | 120.0° |
| C27 | C26 | H25 | H26 | 117.1° | 120.1° |
| C26 | C27 | C28 | H27 | 0.5° | 0.2° |
| C26 | C27 | C32 | H31 | 1.6° | 0.1° |
| C26 | N3 | C2 | H3 | 60.6° | 66.4° |
| C26 | N3 | C2 | H4 | 58.0° | 53.6° |
| C26 | N3 | C4 | H5 | 64.5° | 66.4° |
| N3 | C26 | H25 | H26 | 117.1° | 120.0° |
| H1 | C1 | C2 | H3 | 44.7° | 178.3° |
| H1 | C1 | C2 | H4 | 73.9° | 58.3° |
| H2 | C1 | C2 | H3 | 163.8° | 58.2° |
| H2 | C1 | C2 | H4 | 45.2° | 61.8° |
| H5 | C4 | C5 | H6 | 173.4° | 58.2° |
| H5 | C4 | C5 | H7 | 54.4° | 178.3° |
| H5 | C4 | C33 | H32 | 62.3° | 172.3° |
| H5 | C4 | C33 | H33 | 177.7° | 67.7° |
| H5 | C4 | C33 | H34 | 57.7° | 52.3° |
| H8 | C13 | C14 | H9 | 1.9° | 0.0° |
| H9 | C14 | C15 | H10 | 0.7° | 0.0° |
| H12 | C20 | C21 | H13 | 178.6° | 180.0° |
| H12 | C20 | C21 | H14 | 59.0° | 60.0° |
| H12 | C20 | N19 | H18 | 156.3° | 145.0° |
| H12 | C20 | C25 | H23 | 178.9° | 60.0° |
| H12 | C20 | C25 | H24 | 59.2° | 180.0° |
| H13 | C21 | C22 | H15 | 175.2° | 60.0° |
| H13 | C21 | C22 | H16 | 55.7° | 180.0° |
| H14 | C21 | C22 | H15 | 55.7° | 60.0° |
| H14 | C21 | C22 | H16 | 63.8° | 60.0° |
| H15 | C22 | C23 | H19 | 54.7° | 60.0° |
| H15 | C22 | C23 | H20 | 174.4° | 59.9° |
| H16 | C22 | C23 | H19 | 64.7° | 180.0° |
| H16 | C22 | C23 | H20 | 54.9° | 60.0° |
| H19 | C23 | C24 | H21 | 55.5° | 60.0° |
| H19 | C23 | C24 | H22 | 63.8° | 180.0° |
| H20 | C23 | C24 | H21 | 175.2° | 60.0° |
| H20 | C23 | C24 | H22 | 55.8° | 60.0° |
| H21 | C24 | C25 | H23 | 176.5° | 60.0° |
| H21 | C24 | C25 | H24 | 56.8° | 60.0° |
| H22 | C24 | C25 | H23 | 57.1° | 60.0° |
| H22 | C24 | C25 | H24 | 62.6° | 180.0° |
| H27 | C28 | C29 | H28 | 1.1° | 0.0° |
| H28 | C29 | C30 | H29 | 1.5° | 0.0° |
| H29 | C30 | C31 | H30 | 0.4° | 0.0° |
| H30 | C31 | C32 | H31 | 1.1° | 0.2° |
| H32 | C33 | H33 | H34 | 120.0° | 120.0° |
