BFX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR1 | C2 | sing | 1.89Å | 1.90Å | |
| C2 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C2 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | O5 | sing | 1.36Å | 1.37Å | |
| C3 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| O5 | C8 | sing | 1.43Å | 1.43Å | |
| C6 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C9 | sing | 1.39Å | 1.39Å | Aromatic |
| C8 | C10 | sing | 1.53Å | 1.52Å | |
| C9 | F11 | sing | 1.35Å | 1.34Å | |
| C10 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.51Å | 1.53Å | |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C17 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C18 | doub | 1.40Å | 1.40Å | Aromatic |
| C17 | C18 | sing | 1.40Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.47Å | 1.50Å | |
| C19 | C20 | doub | 1.34Å | 1.36Å | |
| C19 | C21 | sing | 1.50Å | 1.52Å | |
| C20 | C22 | sing | 1.46Å | 1.48Å | |
| C20 | C23 | sing | 1.50Å | 1.52Å | |
| C21 | C24 | sing | 1.53Å | 1.52Å | |
| C22 | O25 | doub | 1.22Å | 1.22Å | |
| C22 | N26 | sing | 1.35Å | 1.36Å | |
| C23 | N27 | sing | 1.47Å | 1.45Å | |
| C24 | N27 | sing | 1.47Å | 1.44Å | |
| N26 | C28 | sing | 1.47Å | 1.47Å | |
| N26 | C29 | sing | 1.47Å | 1.47Å | |
| C28 | C30 | sing | 1.53Å | 1.53Å | |
| C28 | C31 | sing | 1.53Å | 1.53Å | |
| C29 | C32 | sing | 1.51Å | 1.52Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | CL35 | sing | 1.74Å | 1.78Å | |
| C33 | C36 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | C37 | doub | 1.38Å | 1.40Å | Aromatic |
| C36 | C38 | doub | 1.38Å | 1.38Å | Aromatic |
| C37 | C38 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| N27 | HN27 | sing | 1.01Å | 1.00Å | |
| C28 | H28 | 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 | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| BR1 | C2 | C3 | 118.0° | 120.0° |
| BR1 | C2 | C4 | 121.7° | 120.0° |
| C3 | C2 | C4 | 120.3° | 120.0° |
| C2 | C3 | O5 | 118.4° | 120.1° |
| C2 | C3 | C6 | 120.2° | 119.9° |
| C2 | C4 | C7 | 120.2° | 120.1° |
| C2 | C4 | H4 | 119.9° | 120.0° |
| O5 | C3 | C6 | 121.4° | 120.0° |
| C3 | O5 | C8 | 119.9° | 117.0° |
| C3 | C6 | C9 | 119.9° | 119.9° |
| C3 | C6 | H6 | 120.0° | 120.1° |
| C4 | C7 | C9 | 119.3° | 120.1° |
| C7 | C4 | H4 | 119.9° | 120.0° |
| C4 | C7 | H7 | 120.4° | 120.0° |
| O5 | C8 | C10 | 112.5° | 109.5° |
| O5 | C8 | H8 | 108.5° | 109.5° |
| O5 | C8 | H8A | 108.5° | 109.5° |
| C6 | C9 | C7 | 120.1° | 120.0° |
| C6 | C9 | F11 | 118.2° | 120.0° |
| C9 | C6 | H6 | 120.0° | 120.0° |
| C7 | C9 | F11 | 121.7° | 120.0° |
| C9 | C7 | H7 | 120.3° | 120.0° |
| C8 | C10 | C12 | 107.5° | 109.5° |
| C10 | C8 | H8 | 108.5° | 109.5° |
| C10 | C8 | H8A | 108.5° | 109.4° |
| C8 | C10 | H10 | 110.1° | 109.5° |
| C8 | C10 | H10A | 110.1° | 109.4° |
| C10 | C12 | C13 | 113.7° | 109.5° |
| C12 | C10 | H10 | 110.2° | 109.5° |
| C12 | C10 | H10A | 110.1° | 109.5° |
| C10 | C12 | H12 | 108.1° | 109.5° |
| C10 | C12 | H12A | 108.1° | 109.5° |
| C12 | C13 | C14 | 120.5° | 119.9° |
| C12 | C13 | C15 | 120.1° | 119.8° |
| C13 | C12 | H12 | 108.1° | 109.5° |
| C13 | C12 | H12A | 108.1° | 109.5° |
| C14 | C13 | C15 | 119.4° | 120.3° |
| C13 | C14 | C16 | 123.0° | 120.2° |
| C13 | C14 | H14 | 118.5° | 119.9° |
| C13 | C15 | C17 | 117.6° | 120.2° |
| C13 | C15 | H15 | 121.2° | 119.9° |
| C14 | C16 | C18 | 118.0° | 119.8° |
| C16 | C14 | H14 | 118.5° | 119.9° |
| C14 | C16 | H16 | 121.0° | 120.2° |
| C15 | C17 | C18 | 122.9° | 119.8° |
| C17 | C15 | H15 | 121.2° | 119.9° |
| C15 | C17 | H17 | 118.5° | 120.1° |
| C16 | C18 | C17 | 119.2° | 119.6° |
| C16 | C18 | C19 | 121.2° | 120.2° |
| C18 | C16 | H16 | 121.0° | 120.0° |
| C17 | C18 | C19 | 119.6° | 120.1° |
| C18 | C17 | H17 | 118.6° | 120.1° |
| C18 | C19 | C20 | 125.6° | 118.8° |
| C18 | C19 | C21 | 113.6° | 118.8° |
| C20 | C19 | C21 | 120.8° | 122.4° |
| C19 | C20 | C22 | 122.2° | 118.6° |
| C19 | C20 | C23 | 120.9° | 122.8° |
| C19 | C21 | C24 | 113.9° | 109.6° |
| C19 | C21 | H21 | 108.0° | 109.4° |
| C19 | C21 | H21A | 108.0° | 109.5° |
| C22 | C20 | C23 | 116.6° | 118.6° |
| C20 | C22 | O25 | 114.4° | 120.0° |
| C20 | C22 | N26 | 125.3° | 120.0° |
| C20 | C23 | N27 | 111.3° | 110.2° |
| C20 | C23 | H23 | 108.8° | 109.3° |
| C20 | C23 | H23A | 108.9° | 109.4° |
| C21 | C24 | N27 | 111.7° | 108.7° |
| C24 | C21 | H21 | 108.0° | 109.4° |
| C24 | C21 | H21A | 108.0° | 109.5° |
| C21 | C24 | H24 | 108.8° | 109.6° |
| C21 | C24 | H24A | 108.8° | 109.6° |
| O25 | C22 | N26 | 120.4° | 120.0° |
| C22 | N26 | C28 | 126.2° | 120.0° |
| C22 | N26 | C29 | 121.4° | 120.1° |
| C23 | N27 | C24 | 111.7° | 110.5° |
| N27 | C23 | H23 | 108.9° | 109.3° |
| N27 | C23 | H23A | 108.9° | 109.4° |
| C23 | N27 | HN27 | 108.8° | 111.0° |
| N27 | C24 | H24 | 108.7° | 109.6° |
| N27 | C24 | H24A | 108.7° | 109.7° |
| C24 | N27 | HN27 | 108.7° | 111.1° |
| C28 | N26 | C29 | 112.2° | 119.9° |
| N26 | C28 | C30 | 111.4° | 117.5° |
| N26 | C28 | C31 | 111.9° | 117.5° |
| N26 | C28 | H28 | 99.5° | 115.6° |
| N26 | C29 | C32 | 114.6° | 109.4° |
| N26 | C29 | H29 | 107.8° | 109.5° |
| N26 | C29 | H29A | 107.8° | 109.4° |
| C30 | C28 | C31 | 60.0° | 60.0° |
| C28 | C30 | C31 | 59.9° | 60.0° |
| C30 | C28 | H28 | 135.6° | 117.5° |
| C28 | C30 | H30 | 130.9° | 117.5° |
| C28 | C30 | H30A | 131.0° | 117.5° |
| C28 | C31 | C30 | 60.1° | 60.0° |
| C31 | C28 | H28 | 135.1° | 117.5° |
| C28 | C31 | H31 | 130.8° | 117.5° |
| C28 | C31 | H31A | 130.8° | 117.5° |
| C29 | C32 | C33 | 119.3° | 120.0° |
| C29 | C32 | C34 | 123.5° | 120.0° |
| C32 | C29 | H29 | 107.8° | 109.5° |
| C32 | C29 | H29A | 107.8° | 109.5° |
| C31 | C30 | H30 | 131.0° | 117.5° |
| C31 | C30 | H30A | 130.9° | 117.5° |
| C30 | C31 | H31 | 130.8° | 117.4° |
| C30 | C31 | H31A | 130.8° | 117.5° |
| C33 | C32 | C34 | 117.1° | 120.0° |
| C32 | C33 | CL35 | 119.1° | 120.0° |
| C32 | C33 | C36 | 122.3° | 120.0° |
| C32 | C34 | C37 | 121.0° | 120.0° |
| C32 | C34 | H34 | 119.5° | 120.0° |
| CL35 | C33 | C36 | 118.6° | 120.0° |
| C33 | C36 | C38 | 120.1° | 120.0° |
| C33 | C36 | H36 | 119.9° | 120.0° |
| C34 | C37 | C38 | 120.8° | 120.0° |
| C37 | C34 | H34 | 119.5° | 120.0° |
| C34 | C37 | H37 | 119.6° | 119.9° |
| C36 | C38 | C37 | 118.7° | 120.0° |
| C38 | C36 | H36 | 119.9° | 120.0° |
| C36 | C38 | H38 | 120.7° | 120.0° |
| C38 | C37 | H37 | 119.6° | 120.0° |
| C37 | C38 | H38 | 120.6° | 120.0° |
| H8 | C8 | H8A | 110.4° | 109.4° |
| H10 | C10 | H10A | 108.8° | 109.5° |
| H12 | C12 | H12A | 110.8° | 109.5° |
| H21 | C21 | H21A | 110.9° | 109.4° |
| H23 | C23 | H23A | 110.1° | 109.2° |
| H24 | C24 | H24A | 110.2° | 109.7° |
| H29 | C29 | H29A | 111.1° | 109.5° |
| H30 | C30 | H30A | 81.7° | 115.6° |
| H31 | C31 | H31A | 81.9° | 115.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| BR1 | C2 | C3 | C4 | 179.5° | 179.7° |
| BR1 | C2 | C3 | O5 | 0.1° | 0.1° |
| BR1 | C2 | C3 | C6 | 179.1° | 180.0° |
| BR1 | C2 | C4 | C7 | 179.4° | 180.0° |
| BR1 | C2 | C4 | H4 | 0.6° | 0.1° |
| C2 | C3 | O5 | C6 | 179.2° | 179.9° |
| C3 | C2 | C4 | C7 | 0.1° | 0.2° |
| C2 | C3 | O5 | C8 | 163.6° | 180.0° |
| C2 | C3 | C6 | C9 | 0.6° | 0.0° |
| C3 | C2 | C4 | H4 | 179.9° | 179.7° |
| C2 | C3 | C6 | H6 | 179.4° | 180.0° |
| C4 | C2 | C3 | O5 | 179.6° | 179.7° |
| C4 | C2 | C3 | C6 | 0.3° | 0.2° |
| C2 | C4 | C7 | H4 | 180.0° | 179.9° |
| C2 | C4 | C7 | C9 | 0.1° | 0.0° |
| C2 | C4 | C7 | H7 | 179.9° | 180.0° |
| O5 | C3 | C6 | C9 | 179.8° | 179.9° |
| C3 | O5 | C8 | C10 | 172.7° | 179.9° |
| O5 | C3 | C6 | H6 | 0.2° | 0.1° |
| C3 | O5 | C8 | H8 | 52.7° | 60.0° |
| C3 | O5 | C8 | H8A | 67.3° | 60.0° |
| C6 | C3 | O5 | C8 | 17.1° | 0.1° |
| C3 | C6 | C9 | H6 | 180.0° | 179.9° |
| C3 | C6 | C9 | C7 | 0.6° | 0.3° |
| C3 | C6 | C9 | F11 | 179.6° | 180.0° |
| C4 | C7 | C9 | C6 | 0.3° | 0.3° |
| C4 | C7 | C9 | H7 | 180.0° | 180.0° |
| C4 | C7 | C9 | F11 | 179.9° | 180.0° |
| O5 | C8 | C10 | H8 | 120.0° | 120.1° |
| O5 | C8 | C10 | H8A | 120.0° | 120.0° |
| O5 | C8 | C10 | C12 | 171.3° | 180.0° |
| O5 | C8 | H8 | H8A | 118.8° | 120.0° |
| O5 | C8 | C10 | H10 | 51.3° | 59.9° |
| O5 | C8 | C10 | H10A | 68.7° | 60.0° |
| C6 | C9 | C7 | F11 | 179.8° | 179.8° |
| C6 | C9 | C7 | H7 | 179.7° | 179.7° |
| C9 | C7 | C4 | H4 | 179.9° | 179.9° |
| C7 | C9 | C6 | H6 | 179.4° | 179.8° |
| C8 | C10 | C12 | H10 | 120.0° | 120.1° |
| C8 | C10 | C12 | H10A | 120.0° | 119.9° |
| C8 | C10 | C12 | C13 | 81.7° | 180.0° |
| C10 | C8 | H8 | H8A | 118.8° | 119.9° |
| C8 | C10 | H10 | H10A | 120.8° | 119.9° |
| C8 | C10 | C12 | H12 | 38.3° | 59.9° |
| C8 | C10 | C12 | H12A | 158.3° | 60.1° |
| F11 | C9 | C6 | H6 | 0.4° | 0.0° |
| F11 | C9 | C7 | H7 | 0.1° | 0.1° |
| C10 | C12 | C13 | H12 | 120.0° | 120.1° |
| C10 | C12 | C13 | H12A | 120.0° | 120.0° |
| C10 | C12 | C13 | C14 | 126.7° | 90.0° |
| C10 | C12 | C13 | C15 | 53.5° | 90.2° |
| C12 | C10 | C8 | H8 | 68.7° | 59.9° |
| C12 | C10 | C8 | H8A | 51.3° | 60.0° |
| C12 | C10 | H10 | H10A | 120.8° | 120.0° |
| C10 | C12 | H12 | H12A | 118.3° | 120.0° |
| C12 | C13 | C14 | C15 | 179.8° | 179.7° |
| C12 | C13 | C14 | C16 | 179.8° | 180.0° |
| C12 | C13 | C15 | C17 | 179.0° | 180.0° |
| C13 | C12 | C10 | H10 | 158.3° | 60.0° |
| C13 | C12 | C10 | H10A | 38.3° | 60.0° |
| C13 | C12 | H12 | H12A | 118.3° | 120.0° |
| C12 | C13 | C14 | H14 | 0.2° | 0.0° |
| C12 | C13 | C15 | H15 | 1.0° | 0.1° |
| C13 | C14 | C16 | H14 | 180.0° | 180.0° |
| C14 | C13 | C15 | C17 | 0.9° | 0.2° |
| C13 | C14 | C16 | C18 | 0.1° | 0.0° |
| C14 | C13 | C12 | H12 | 6.7° | 30.0° |
| C14 | C13 | C12 | H12A | 113.3° | 150.0° |
| C14 | C13 | C15 | H15 | 179.1° | 179.7° |
| C13 | C14 | C16 | H16 | 179.9° | 180.0° |
| C15 | C13 | C14 | C16 | 0.1° | 0.3° |
| C13 | C15 | C17 | H15 | 180.0° | 179.9° |
| C13 | C15 | C17 | C18 | 1.6° | 0.0° |
| C15 | C13 | C12 | H12 | 173.5° | 149.7° |
| C15 | C13 | C12 | H12A | 66.5° | 29.7° |
| C15 | C13 | C14 | H14 | 179.9° | 179.7° |
| C13 | C15 | C17 | H17 | 178.3° | 180.0° |
| C14 | C16 | C18 | H16 | 180.0° | 180.0° |
| C14 | C16 | C18 | C17 | 0.6° | 0.3° |
| C14 | C16 | C18 | C19 | 178.2° | 180.0° |
| C15 | C17 | C18 | C16 | 1.5° | 0.3° |
| C15 | C17 | C18 | H17 | 180.0° | 179.9° |
| C15 | C17 | C18 | C19 | 179.1° | 180.0° |
| C16 | C18 | C17 | C19 | 177.6° | 179.8° |
| C16 | C18 | C19 | C20 | 53.6° | 115.0° |
| C16 | C18 | C19 | C21 | 123.3° | 65.2° |
| C18 | C16 | C14 | H14 | 179.9° | 180.0° |
| C16 | C18 | C17 | H17 | 178.4° | 179.8° |
| C17 | C18 | C19 | C20 | 128.9° | 64.8° |
| C17 | C18 | C19 | C21 | 54.2° | 115.0° |
| C18 | C17 | C15 | H15 | 178.4° | 179.9° |
| C17 | C18 | C16 | H16 | 179.4° | 179.7° |
| C18 | C19 | C20 | C21 | 176.7° | 179.8° |
| C18 | C19 | C20 | C22 | 6.5° | 0.5° |
| C18 | C19 | C20 | C23 | 178.5° | 179.5° |
| C18 | C19 | C21 | C24 | 174.9° | 163.3° |
| C19 | C18 | C16 | H16 | 1.9° | 0.0° |
| C19 | C18 | C17 | H17 | 0.9° | 0.0° |
| C18 | C19 | C21 | H21 | 54.9° | 76.7° |
| C18 | C19 | C21 | H21A | 65.1° | 43.2° |
| C19 | C20 | C22 | C23 | 175.3° | 180.0° |
| C20 | C19 | C21 | C24 | 2.2° | 16.9° |
| C19 | C20 | C22 | O25 | 115.1° | 0.7° |
| C19 | C20 | C22 | N26 | 65.1° | 179.3° |
| C19 | C20 | C23 | N27 | 20.8° | 17.2° |
| C20 | C19 | C21 | H21 | 122.2° | 103.1° |
| C20 | C19 | C21 | H21A | 117.8° | 137.0° |
| C19 | C20 | C23 | H23 | 140.8° | 102.9° |
| C19 | C20 | C23 | H23A | 99.2° | 137.5° |
| C21 | C19 | C20 | C22 | 170.2° | 179.3° |
| C21 | C19 | C20 | C23 | 4.8° | 0.7° |
| C19 | C21 | C24 | H21 | 120.0° | 120.0° |
| C19 | C21 | C24 | H21A | 120.0° | 120.1° |
| C19 | C21 | C24 | N27 | 35.1° | 49.6° |
| C19 | C21 | H21 | H21A | 118.2° | 119.9° |
| C19 | C21 | C24 | H24 | 84.9° | 169.3° |
| C19 | C21 | C24 | H24A | 155.1° | 70.2° |
| C20 | C22 | O25 | N26 | 179.8° | 180.0° |
| C22 | C20 | C23 | N27 | 163.9° | 162.8° |
| C20 | C22 | N26 | C28 | 1.0° | 7.3° |
| C20 | C22 | N26 | C29 | 173.7° | 172.7° |
| C22 | C20 | C23 | H23 | 43.9° | 77.1° |
| C22 | C20 | C23 | H23A | 76.1° | 42.5° |
| C23 | C20 | C22 | O25 | 60.2° | 179.3° |
| C23 | C20 | C22 | N26 | 119.6° | 0.7° |
| C20 | C23 | N27 | H23 | 120.0° | 120.2° |
| C20 | C23 | N27 | H23A | 120.0° | 120.3° |
| C20 | C23 | N27 | C24 | 54.7° | 51.4° |
| C20 | C23 | H23 | H23A | 119.2° | 119.7° |
| C20 | C23 | N27 | HN27 | 65.3° | 175.1° |
| C21 | C24 | N27 | C23 | 62.8° | 69.8° |
| C21 | C24 | N27 | H24 | 120.0° | 119.7° |
| C21 | C24 | N27 | H24A | 120.0° | 119.8° |
| C24 | C21 | H21 | H21A | 118.2° | 119.9° |
| C21 | C24 | H24 | H24A | 119.1° | 120.4° |
| C21 | C24 | N27 | HN27 | 57.2° | 166.5° |
| O25 | C22 | N26 | C28 | 178.8° | 172.8° |
| O25 | C22 | N26 | C29 | 6.5° | 7.2° |
| C22 | N26 | C28 | C29 | 175.1° | 180.0° |
| C22 | N26 | C28 | C30 | 58.1° | 112.6° |
| C22 | N26 | C28 | C31 | 123.1° | 178.8° |
| C22 | N26 | C29 | C32 | 79.7° | 77.4° |
| C22 | N26 | C28 | H28 | 89.5° | 33.1° |
| C22 | N26 | C29 | H29 | 160.3° | 162.5° |
| C22 | N26 | C29 | H29A | 40.3° | 42.5° |
| C23 | N27 | C24 | HN27 | 120.0° | 123.6° |
| N27 | C23 | H23 | H23A | 119.3° | 119.7° |
| C23 | N27 | C24 | H24 | 57.2° | 170.5° |
| C23 | N27 | C24 | H24A | 177.2° | 50.0° |
| N27 | C24 | C21 | H21 | 155.1° | 70.4° |
| N27 | C24 | C21 | H21A | 84.9° | 169.7° |
| C24 | N27 | C23 | H23 | 174.7° | 68.8° |
| C24 | N27 | C23 | H23A | 65.3° | 171.7° |
| N27 | C24 | H24 | H24A | 119.0° | 120.5° |
| N26 | C28 | C30 | C31 | 103.7° | 107.5° |
| N26 | C28 | C30 | H28 | 130.8° | 145.0° |
| N26 | C28 | C31 | H28 | 131.1° | 145.1° |
| C28 | N26 | C29 | C32 | 104.9° | 102.6° |
| C28 | N26 | C29 | H29 | 15.1° | 17.5° |
| C28 | N26 | C29 | H29A | 135.1° | 137.4° |
| N26 | C28 | C30 | H30 | 16.3° | 0.0° |
| N26 | C28 | C30 | H30A | 136.3° | 145.0° |
| N26 | C28 | C31 | H31 | 137.2° | 145.1° |
| N26 | C28 | C31 | H31A | 17.2° | 0.0° |
| C29 | N26 | C28 | C30 | 126.8° | 67.5° |
| C29 | N26 | C28 | C31 | 61.8° | 1.2° |
| N26 | C29 | C32 | H29 | 120.0° | 120.0° |
| N26 | C29 | C32 | H29A | 120.0° | 119.9° |
| N26 | C29 | C32 | C33 | 175.4° | 96.8° |
| N26 | C29 | C32 | C34 | 4.3° | 83.6° |
| C29 | N26 | C28 | H28 | 85.6° | 146.9° |
| N26 | C29 | H29 | H29A | 117.9° | 119.9° |
| C30 | C28 | C31 | H28 | 126.2° | 107.5° |
| C28 | C30 | C31 | H30 | 120.0° | 107.5° |
| C28 | C30 | C31 | H30A | 120.0° | 107.4° |
| C28 | C30 | H30 | H30A | 138.6° | 145.6° |
| C30 | C28 | C31 | H31 | 120.0° | 107.4° |
| C30 | C28 | C31 | H31A | 120.0° | 107.5° |
| C28 | C31 | H31 | H31A | 138.6° | 145.8° |
| C29 | C32 | C33 | C34 | 179.7° | 179.6° |
| C29 | C32 | C33 | CL35 | 0.2° | 0.1° |
| C29 | C32 | C33 | C36 | 179.4° | 179.9° |
| C29 | C32 | C34 | C37 | 179.7° | 180.0° |
| C32 | C29 | H29 | H29A | 117.9° | 120.1° |
| C29 | C32 | C34 | H34 | 0.3° | 0.1° |
| C31 | C30 | H30 | H30A | 138.6° | 145.8° |
| C30 | C31 | H31 | H31A | 138.6° | 145.6° |
| C32 | C33 | CL35 | C36 | 179.6° | 180.0° |
| C33 | C32 | C34 | C37 | 0.0° | 0.3° |
| C32 | C33 | C36 | C38 | 0.7° | 0.0° |
| C33 | C32 | C29 | H29 | 55.4° | 23.2° |
| C33 | C32 | C29 | H29A | 64.6° | 143.3° |
| C33 | C32 | C34 | H34 | 180.0° | 179.7° |
| C32 | C33 | C36 | H36 | 179.3° | 179.9° |
| C34 | C32 | C33 | CL35 | 179.9° | 179.7° |
| C34 | C32 | C33 | C36 | 0.3° | 0.3° |
| C32 | C34 | C37 | H34 | 180.0° | 180.0° |
| C32 | C34 | C37 | C38 | 0.1° | 0.0° |
| C34 | C32 | C29 | H29 | 124.3° | 156.4° |
| C34 | C32 | C29 | H29A | 115.7° | 36.3° |
| C32 | C34 | C37 | H37 | 179.9° | 180.0° |
| CL35 | C33 | C36 | C38 | 179.7° | 180.0° |
| CL35 | C33 | C36 | H36 | 0.3° | 0.1° |
| C33 | C36 | C38 | H36 | 180.0° | 179.9° |
| C33 | C36 | C38 | C37 | 0.7° | 0.3° |
| C33 | C36 | C38 | H38 | 179.3° | 180.0° |
| C34 | C37 | C38 | C36 | 0.4° | 0.3° |
| C34 | C37 | C38 | H37 | 180.0° | 179.9° |
| C34 | C37 | C38 | H38 | 179.5° | 180.0° |
| C36 | C38 | C37 | H38 | 180.0° | 179.7° |
| C36 | C38 | C37 | H37 | 179.6° | 179.7° |
| C38 | C37 | C34 | H34 | 179.9° | 180.0° |
| C37 | C38 | C36 | H36 | 179.3° | 179.8° |
| H4 | C4 | C7 | H7 | 0.1° | 0.1° |
| H8 | C8 | C10 | H10 | 171.3° | 180.0° |
| H8 | C8 | C10 | H10A | 51.3° | 60.1° |
| H8A | C8 | C10 | H10 | 68.7° | 60.1° |
| H8A | C8 | C10 | H10A | 171.3° | 180.0° |
| H10 | C10 | C12 | H12 | 81.7° | 180.0° |
| H10 | C10 | C12 | H12A | 38.3° | 60.0° |
| H10A | C10 | C12 | H12 | 158.3° | 60.0° |
| H10A | C10 | C12 | H12A | 81.7° | 180.0° |
| H14 | C14 | C16 | H16 | 0.1° | 0.0° |
| H15 | C15 | C17 | H17 | 1.6° | 0.1° |
| H21 | C21 | C24 | H24 | 35.0° | 49.3° |
| H21 | C21 | C24 | H24A | 85.0° | 169.8° |
| H21A | C21 | C24 | H24 | 155.1° | 70.6° |
| H21A | C21 | C24 | H24A | 35.1° | 49.9° |
| H23 | C23 | N27 | HN27 | 54.7° | 54.9° |
| H23A | C23 | N27 | HN27 | 174.7° | 64.7° |
| H24 | C24 | N27 | HN27 | 177.2° | 46.8° |
| H24A | C24 | N27 | HN27 | 62.8° | 73.7° |
| H28 | C28 | C30 | H30 | 114.5° | 144.9° |
| H28 | C28 | C30 | H30A | 5.5° | 0.0° |
| H28 | C28 | C31 | H31 | 6.2° | 0.0° |
| H28 | C28 | C31 | H31A | 113.9° | 145.1° |
| H30 | C30 | C31 | H31 | 120.0° | 145.0° |
| H30 | C30 | C31 | H31A | 0.0° | 0.1° |
| H30A | C30 | C31 | H31 | 0.0° | 0.1° |
| H30A | C30 | C31 | H31A | 120.0° | 145.0° |
| H34 | C34 | C37 | H37 | 0.1° | 0.1° |
| H36 | C36 | C38 | H38 | 0.8° | 0.1° |
| H37 | C37 | C38 | H38 | 0.4° | 0.0° |
