U3F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N27 | C24 | sing | 1.35Å | 1.35Å | |
| O40 | C37 | sing | 1.43Å | 1.44Å | |
| O26 | C24 | doub | 1.22Å | 1.23Å | |
| C24 | C23 | sing | 1.47Å | 1.51Å | |
| C38 | C37 | sing | 1.53Å | 1.55Å | |
| C38 | C39 | sing | 1.53Å | 1.55Å | |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C36 | C35 | sing | 1.53Å | 1.54Å | |
| C22 | C23 | doub | 1.40Å | 1.41Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C17 | sing | 1.41Å | 1.40Å | Aromatic |
| C39 | C34 | sing | 1.53Å | 1.55Å | |
| CL18 | C1 | sing | 1.74Å | 1.75Å | |
| C21 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C34 | C35 | sing | 1.53Å | 1.54Å | |
| C34 | N33 | sing | 1.47Å | 1.48Å | |
| F31 | C2 | sing | 1.35Å | 1.32Å | |
| C1 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C17 | C6 | sing | 1.48Å | 1.49Å | |
| C17 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C9 | sing | 1.52Å | 1.51Å | |
| C11 | N33 | sing | 1.47Å | 1.47Å | |
| C11 | C8 | sing | 1.53Å | 1.54Å | |
| C4 | O7 | sing | 1.36Å | 1.39Å | |
| C20 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | O28 | sing | 1.36Å | 1.37Å | |
| C9 | C8 | sing | 1.55Å | 1.57Å | |
| C19 | F25 | sing | 1.35Å | 1.34Å | |
| O7 | C8 | sing | 1.44Å | 1.47Å | |
| C8 | C10 | sing | 1.51Å | 1.56Å | |
| F30 | C29 | sing | 1.40Å | 1.36Å | |
| O28 | C29 | sing | 1.43Å | 1.42Å | |
| C29 | F32 | sing | 1.40Å | 1.35Å | |
| C10 | C16 | doub | 1.38Å | 1.41Å | Aromatic |
| C10 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.41Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.08Å | 1.08Å | |
| C14 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.08Å | 1.08Å | |
| C16 | H8 | sing | 1.08Å | 1.08Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C22 | H10 | sing | 1.08Å | 1.08Å | |
| C29 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| N27 | H14 | sing | 0.97Å | 1.00Å | |
| N27 | H15 | sing | 0.97Å | 1.00Å | |
| N33 | H16 | sing | 1.01Å | 1.00Å | |
| C34 | H18 | sing | 1.09Å | 1.10Å | |
| C35 | H19 | sing | 1.09Å | 1.10Å | |
| C35 | H20 | sing | 1.09Å | 1.10Å | |
| C36 | H21 | sing | 1.09Å | 1.10Å | |
| C36 | H22 | sing | 1.09Å | 1.10Å | |
| C37 | H23 | sing | 1.09Å | 1.10Å | |
| C38 | H24 | sing | 1.09Å | 1.10Å | |
| C38 | H25 | sing | 1.09Å | 1.10Å | |
| C39 | H26 | sing | 1.09Å | 1.10Å | |
| C39 | H27 | sing | 1.09Å | 1.10Å | |
| O40 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N27 | C24 | O26 | 121.9° | 120.0° |
| N27 | C24 | C23 | 120.2° | 120.0° |
| C24 | N27 | H14 | 120.0° | 120.0° |
| C24 | N27 | H15 | 120.0° | 120.0° |
| O40 | C37 | C38 | 111.8° | 109.5° |
| O40 | C37 | C36 | 107.2° | 109.5° |
| O40 | C37 | H23 | 110.5° | 109.5° |
| C37 | O40 | H28 | 109.5° | 114.0° |
| O26 | C24 | C23 | 117.8° | 120.0° |
| C24 | C23 | C22 | 118.0° | 120.2° |
| C24 | C23 | C17 | 121.5° | 120.2° |
| C37 | C38 | C39 | 111.2° | 109.5° |
| C38 | C37 | C36 | 109.4° | 109.5° |
| C38 | C37 | H23 | 108.9° | 109.5° |
| C37 | C38 | H24 | 109.0° | 109.5° |
| C37 | C38 | H25 | 109.0° | 109.5° |
| C38 | C39 | C34 | 109.4° | 109.5° |
| C39 | C38 | H24 | 109.1° | 109.5° |
| C39 | C38 | H25 | 109.0° | 109.4° |
| C38 | C39 | H26 | 109.5° | 109.5° |
| C38 | C39 | H27 | 109.5° | 109.4° |
| C37 | C36 | C35 | 107.0° | 109.5° |
| C37 | C36 | H21 | 110.1° | 109.5° |
| C37 | C36 | H22 | 110.1° | 109.5° |
| C36 | C37 | H23 | 109.0° | 109.5° |
| C36 | C35 | C34 | 106.9° | 109.4° |
| C36 | C35 | H19 | 110.1° | 109.5° |
| C36 | C35 | H20 | 110.1° | 109.5° |
| C35 | C36 | H21 | 110.1° | 109.4° |
| C35 | C36 | H22 | 110.1° | 109.5° |
| C23 | C22 | C21 | 120.5° | 120.1° |
| C22 | C23 | C17 | 120.5° | 119.7° |
| C23 | C22 | H10 | 119.7° | 119.9° |
| C22 | C21 | C20 | 118.4° | 120.4° |
| C22 | C21 | H9 | 120.8° | 119.8° |
| C21 | C22 | H10 | 119.7° | 120.0° |
| C23 | C17 | C6 | 121.8° | 120.2° |
| C23 | C17 | C19 | 118.7° | 119.6° |
| C39 | C34 | C35 | 108.5° | 109.5° |
| C39 | C34 | N33 | 111.2° | 109.5° |
| C39 | C34 | H18 | 108.4° | 109.5° |
| C34 | C39 | H26 | 109.5° | 109.5° |
| C34 | C39 | H27 | 109.5° | 109.5° |
| CL18 | C1 | C2 | 118.2° | 120.3° |
| CL18 | C1 | C6 | 121.0° | 120.2° |
| C21 | C20 | C19 | 121.5° | 120.3° |
| C21 | C20 | O28 | 123.4° | 119.9° |
| C20 | C21 | H9 | 120.8° | 119.8° |
| C35 | C34 | N33 | 110.6° | 109.5° |
| C35 | C34 | H18 | 108.6° | 109.5° |
| C34 | C35 | H19 | 110.1° | 109.5° |
| C34 | C35 | H20 | 110.1° | 109.5° |
| C34 | N33 | C11 | 112.4° | 111.0° |
| C34 | N33 | H16 | 108.7° | 111.1° |
| N33 | C34 | H18 | 109.4° | 109.4° |
| F31 | C2 | C1 | 118.5° | 119.8° |
| F31 | C2 | C3 | 119.9° | 119.8° |
| C2 | C1 | C6 | 120.7° | 119.5° |
| C1 | C2 | C3 | 121.5° | 120.5° |
| C1 | C6 | C17 | 122.8° | 120.1° |
| C1 | C6 | C5 | 117.0° | 119.8° |
| C6 | C17 | C19 | 119.3° | 120.2° |
| C17 | C6 | C5 | 120.2° | 120.1° |
| C17 | C19 | C20 | 120.1° | 119.9° |
| C17 | C19 | F25 | 120.3° | 120.0° |
| C2 | C3 | C4 | 117.6° | 120.5° |
| C2 | C3 | H1 | 121.2° | 119.7° |
| C6 | C5 | C4 | 122.2° | 120.7° |
| C6 | C5 | C9 | 129.9° | 132.2° |
| C3 | C4 | C5 | 120.8° | 119.0° |
| C3 | C4 | O7 | 122.7° | 129.7° |
| C4 | C3 | H1 | 121.2° | 119.8° |
| C4 | C5 | C9 | 107.9° | 107.1° |
| C5 | C4 | O7 | 116.4° | 111.2° |
| C5 | C9 | C8 | 101.2° | 101.9° |
| C5 | C9 | H12 | 111.5° | 110.9° |
| C5 | C9 | H13 | 111.5° | 111.0° |
| N33 | C11 | C8 | 113.2° | 109.5° |
| N33 | C11 | H2 | 108.5° | 109.5° |
| N33 | C11 | H3 | 108.6° | 109.5° |
| C11 | N33 | H16 | 108.8° | 111.0° |
| C11 | C8 | C9 | 106.5° | 110.8° |
| C11 | C8 | O7 | 108.8° | 110.7° |
| C11 | C8 | C10 | 110.9° | 110.7° |
| C8 | C11 | H2 | 108.5° | 109.5° |
| C8 | C11 | H3 | 108.5° | 109.4° |
| C4 | O7 | C8 | 104.4° | 109.2° |
| C19 | C20 | O28 | 115.1° | 119.8° |
| C20 | C19 | F25 | 119.5° | 120.1° |
| C20 | O28 | C29 | 123.6° | 117.0° |
| C9 | C8 | O7 | 109.3° | 102.7° |
| C9 | C8 | C10 | 110.3° | 110.9° |
| C8 | C9 | H12 | 111.5° | 110.9° |
| C8 | C9 | H13 | 111.5° | 111.0° |
| O7 | C8 | C10 | 111.0° | 110.8° |
| C8 | C10 | C16 | 120.9° | 120.0° |
| C8 | C10 | C12 | 121.7° | 120.0° |
| F30 | C29 | O28 | 107.5° | 109.5° |
| F30 | C29 | F32 | 109.6° | 109.5° |
| F30 | C29 | H11 | 112.0° | 109.4° |
| O28 | C29 | F32 | 104.1° | 109.5° |
| O28 | C29 | H11 | 111.1° | 109.5° |
| F32 | C29 | H11 | 112.1° | 109.4° |
| C16 | C10 | C12 | 117.4° | 120.0° |
| C10 | C16 | C15 | 121.4° | 120.0° |
| C10 | C16 | H8 | 119.3° | 120.0° |
| C10 | C12 | C13 | 121.4° | 120.0° |
| C10 | C12 | H4 | 119.3° | 120.0° |
| C16 | C15 | C14 | 120.5° | 120.0° |
| C16 | C15 | H7 | 119.7° | 120.0° |
| C15 | C16 | H8 | 119.3° | 120.0° |
| C12 | C13 | C14 | 120.3° | 120.0° |
| C13 | C12 | H4 | 119.3° | 120.0° |
| C12 | C13 | H5 | 119.9° | 120.0° |
| C15 | C14 | C13 | 118.8° | 120.0° |
| C15 | C14 | H6 | 120.6° | 120.1° |
| C14 | C15 | H7 | 119.8° | 120.0° |
| C14 | C13 | H5 | 119.8° | 120.0° |
| C13 | C14 | H6 | 120.6° | 119.9° |
| H2 | C11 | H3 | 109.5° | 109.5° |
| H12 | C9 | H13 | 109.4° | 110.9° |
| H14 | N27 | H15 | 120.0° | 120.0° |
| H19 | C35 | H20 | 109.5° | 109.5° |
| H21 | C36 | H22 | 109.5° | 109.4° |
| H24 | C38 | H25 | 109.5° | 109.5° |
| H26 | C39 | H27 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N27 | C24 | O26 | C23 | 177.8° | 180.0° |
| N27 | C24 | C23 | C22 | 54.3° | 0.0° |
| N27 | C24 | C23 | C17 | 125.6° | 179.5° |
| C24 | N27 | H14 | H15 | 180.0° | 180.0° |
| O40 | C37 | C38 | C36 | 118.6° | 120.0° |
| O40 | C37 | C38 | H23 | 122.4° | 120.0° |
| O40 | C37 | C38 | C39 | 175.3° | 180.0° |
| O40 | C37 | C36 | H23 | 119.6° | 120.0° |
| O40 | C37 | C36 | C35 | 175.6° | 180.0° |
| O40 | C37 | C36 | H21 | 64.8° | 60.0° |
| O40 | C37 | C36 | H22 | 56.0° | 60.0° |
| O40 | C37 | C38 | H24 | 64.4° | 60.1° |
| O40 | C37 | C38 | H25 | 55.1° | 60.0° |
| O26 | C24 | C23 | C22 | 123.6° | 180.0° |
| O26 | C24 | C23 | C17 | 56.5° | 0.5° |
| O26 | C24 | N27 | H14 | 0.0° | 179.9° |
| O26 | C24 | N27 | H15 | 180.0° | 0.0° |
| C24 | C23 | C22 | C17 | 179.9° | 179.5° |
| C24 | C23 | C22 | C21 | 179.5° | 180.0° |
| C24 | C23 | C17 | C6 | 1.6° | 0.3° |
| C24 | C23 | C17 | C19 | 177.2° | 180.0° |
| C24 | C23 | C22 | H10 | 0.5° | 0.5° |
| C23 | C24 | N27 | H14 | 177.7° | 0.1° |
| C23 | C24 | N27 | H15 | 2.3° | 180.0° |
| C37 | C38 | C39 | H24 | 120.2° | 120.0° |
| C37 | C38 | C39 | H25 | 120.2° | 120.0° |
| C38 | C37 | C36 | H23 | 119.0° | 120.0° |
| C38 | C37 | C36 | C35 | 63.0° | 60.0° |
| C37 | C38 | C39 | C34 | 54.4° | 60.0° |
| C38 | C37 | C36 | H21 | 56.6° | 180.0° |
| C38 | C37 | C36 | H22 | 177.4° | 60.0° |
| C37 | C38 | H24 | H25 | 119.2° | 120.1° |
| C37 | C38 | C39 | H26 | 65.6° | 180.0° |
| C37 | C38 | C39 | H27 | 174.4° | 60.0° |
| C38 | C37 | O40 | H28 | 180.0° | 60.0° |
| C39 | C38 | C37 | C36 | 56.7° | 60.0° |
| C38 | C39 | C34 | H26 | 120.0° | 120.0° |
| C38 | C39 | C34 | H27 | 120.0° | 120.0° |
| C38 | C39 | C34 | C35 | 59.4° | 60.0° |
| C38 | C39 | C34 | N33 | 178.7° | 180.0° |
| C38 | C39 | C34 | H18 | 58.4° | 60.1° |
| C39 | C38 | C37 | H23 | 62.3° | 60.0° |
| C39 | C38 | H24 | H25 | 119.2° | 120.0° |
| C38 | C39 | H26 | H27 | 120.0° | 119.9° |
| C37 | C36 | C35 | H21 | 119.6° | 120.0° |
| C37 | C36 | C35 | H22 | 119.6° | 120.0° |
| C37 | C36 | C35 | C34 | 68.2° | 60.0° |
| C37 | C36 | C35 | H19 | 172.2° | 60.0° |
| C37 | C36 | C35 | H20 | 51.4° | 180.0° |
| C37 | C36 | H21 | H22 | 121.2° | 120.0° |
| C36 | C37 | C38 | H24 | 177.0° | 179.9° |
| C36 | C37 | C38 | H25 | 63.5° | 60.0° |
| C36 | C37 | O40 | H28 | 60.2° | 180.0° |
| C36 | C35 | C34 | C39 | 66.7° | 60.0° |
| C36 | C35 | C34 | H19 | 119.6° | 120.0° |
| C36 | C35 | C34 | H20 | 119.6° | 120.0° |
| C36 | C35 | C34 | N33 | 171.0° | 180.0° |
| C36 | C35 | C34 | H18 | 50.9° | 60.0° |
| C36 | C35 | H19 | H20 | 121.2° | 120.0° |
| C35 | C36 | H21 | H22 | 121.1° | 120.0° |
| C35 | C36 | C37 | H23 | 56.0° | 59.9° |
| C23 | C22 | C21 | H10 | 180.0° | 179.5° |
| C23 | C22 | C21 | C20 | 2.3° | 0.2° |
| C22 | C23 | C17 | C6 | 178.5° | 179.8° |
| C22 | C23 | C17 | C19 | 2.9° | 0.5° |
| C23 | C22 | C21 | H9 | 177.7° | 179.7° |
| C21 | C22 | C23 | C17 | 0.6° | 0.5° |
| C22 | C21 | C20 | H9 | 180.0° | 179.9° |
| C22 | C21 | C20 | C19 | 2.9° | 0.1° |
| C22 | C21 | C20 | O28 | 177.6° | 180.0° |
| C23 | C17 | C6 | C1 | 68.3° | 90.2° |
| C23 | C17 | C6 | C19 | 175.6° | 179.7° |
| C23 | C17 | C6 | C5 | 110.0° | 89.7° |
| C23 | C17 | C19 | C20 | 2.3° | 0.2° |
| C23 | C17 | C19 | F25 | 175.9° | 179.8° |
| C17 | C23 | C22 | H10 | 179.4° | 180.0° |
| C39 | C34 | C35 | N33 | 122.3° | 120.0° |
| C39 | C34 | C35 | H18 | 117.7° | 120.0° |
| C39 | C34 | N33 | H18 | 119.7° | 120.0° |
| C39 | C34 | N33 | C11 | 65.4° | 85.0° |
| C39 | C34 | N33 | H16 | 174.1° | 151.1° |
| C39 | C34 | C35 | H19 | 173.7° | 60.0° |
| C39 | C34 | C35 | H20 | 52.9° | 180.0° |
| C34 | C39 | C38 | H24 | 174.7° | 179.9° |
| C34 | C39 | C38 | H25 | 65.8° | 60.0° |
| C34 | C39 | H26 | H27 | 120.0° | 120.0° |
| CL18 | C1 | C2 | F31 | 3.7° | 0.4° |
| CL18 | C1 | C2 | C6 | 178.2° | 179.8° |
| CL18 | C1 | C6 | C17 | 6.7° | 0.2° |
| CL18 | C1 | C2 | C3 | 175.8° | 179.6° |
| CL18 | C1 | C6 | C5 | 175.0° | 179.8° |
| C21 | C20 | C19 | C17 | 0.5° | 0.1° |
| C21 | C20 | C19 | O28 | 179.6° | 179.9° |
| C21 | C20 | C19 | F25 | 178.7° | 179.9° |
| C21 | C20 | O28 | C29 | 15.4° | 0.1° |
| C20 | C21 | C22 | H10 | 177.7° | 179.7° |
| C35 | C34 | N33 | H18 | 119.6° | 120.0° |
| C35 | C34 | N33 | C11 | 173.9° | 155.0° |
| C35 | C34 | N33 | H16 | 53.4° | 31.0° |
| C34 | C35 | H19 | H20 | 121.2° | 120.0° |
| C34 | C35 | C36 | H21 | 51.4° | 180.0° |
| C34 | C35 | C36 | H22 | 172.2° | 60.0° |
| C35 | C34 | C39 | H26 | 60.6° | 180.0° |
| C35 | C34 | C39 | H27 | 179.4° | 60.0° |
| C34 | N33 | C11 | H16 | 120.4° | 124.0° |
| C34 | N33 | C11 | C8 | 150.7° | 180.0° |
| C34 | N33 | C11 | H2 | 88.7° | 60.0° |
| C34 | N33 | C11 | H3 | 30.2° | 60.0° |
| N33 | C34 | C35 | H19 | 51.4° | 60.0° |
| N33 | C34 | C35 | H20 | 69.4° | 60.0° |
| N33 | C34 | C39 | H26 | 61.3° | 60.0° |
| N33 | C34 | C39 | H27 | 58.7° | 60.0° |
| F31 | C2 | C1 | C3 | 179.5° | 180.0° |
| F31 | C2 | C1 | C6 | 178.1° | 179.8° |
| F31 | C2 | C3 | C4 | 179.0° | 179.9° |
| F31 | C2 | C3 | H1 | 1.0° | 0.1° |
| C2 | C1 | C6 | C17 | 175.1° | 180.0° |
| C2 | C1 | C6 | C5 | 3.2° | 0.0° |
| C1 | C2 | C3 | C4 | 0.5° | 0.1° |
| C1 | C2 | C3 | H1 | 179.5° | 179.9° |
| C1 | C6 | C17 | C5 | 178.2° | 180.0° |
| C1 | C6 | C17 | C19 | 116.2° | 90.0° |
| C6 | C1 | C2 | C3 | 2.4° | 0.2° |
| C1 | C6 | C5 | C4 | 1.2° | 0.3° |
| C1 | C6 | C5 | C9 | 177.2° | 179.5° |
| C17 | C6 | C5 | C4 | 177.2° | 179.7° |
| C17 | C6 | C5 | C9 | 4.5° | 0.6° |
| C6 | C17 | C19 | C20 | 178.0° | 180.0° |
| C6 | C17 | C19 | F25 | 0.2° | 0.0° |
| C19 | C17 | C6 | C5 | 65.6° | 90.0° |
| C17 | C19 | C20 | F25 | 178.2° | 180.0° |
| C17 | C19 | C20 | O28 | 179.8° | 180.0° |
| C2 | C3 | C4 | H1 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 2.6° | 0.2° |
| C2 | C3 | C4 | O7 | 179.2° | 179.4° |
| C6 | C5 | C4 | C3 | 1.8° | 0.4° |
| C6 | C5 | C4 | C9 | 178.6° | 179.8° |
| C6 | C5 | C4 | O7 | 178.6° | 179.3° |
| C6 | C5 | C9 | C8 | 174.9° | 164.3° |
| C6 | C5 | C9 | H12 | 66.5° | 77.6° |
| C6 | C5 | C9 | H13 | 56.2° | 46.1° |
| C3 | C4 | C5 | O7 | 176.8° | 179.7° |
| C3 | C4 | C5 | C9 | 179.6° | 179.4° |
| C3 | C4 | O7 | C8 | 175.0° | 161.5° |
| C4 | C5 | C9 | C8 | 3.6° | 15.5° |
| C5 | C4 | O7 | C8 | 8.2° | 18.8° |
| C5 | C4 | C3 | H1 | 177.4° | 179.8° |
| C4 | C5 | C9 | H12 | 115.0° | 102.6° |
| C4 | C5 | C9 | H13 | 122.3° | 133.7° |
| C5 | C9 | C8 | C11 | 125.8° | 143.6° |
| C9 | C5 | C4 | O7 | 2.8° | 0.9° |
| C5 | C9 | C8 | H12 | 118.7° | 118.1° |
| C5 | C9 | C8 | H13 | 118.7° | 118.2° |
| C5 | C9 | C8 | O7 | 8.5° | 25.3° |
| C5 | C9 | C8 | C10 | 113.8° | 93.1° |
| C5 | C9 | H12 | H13 | 123.9° | 123.8° |
| N33 | C11 | C8 | H2 | 120.6° | 120.0° |
| N33 | C11 | C8 | H3 | 120.6° | 120.0° |
| N33 | C11 | C8 | C9 | 172.6° | 174.8° |
| N33 | C11 | C8 | O7 | 55.0° | 61.5° |
| N33 | C11 | C8 | C10 | 67.3° | 61.8° |
| N33 | C11 | H2 | H3 | 118.3° | 120.0° |
| C11 | N33 | C34 | H18 | 54.2° | 35.0° |
| C11 | C8 | O7 | C4 | 126.0° | 146.0° |
| C11 | C8 | C9 | O7 | 117.3° | 118.3° |
| C11 | C8 | C9 | C10 | 120.4° | 123.3° |
| C11 | C8 | O7 | C10 | 122.2° | 123.2° |
| C11 | C8 | C10 | C16 | 44.4° | 89.3° |
| C11 | C8 | C10 | C12 | 135.2° | 90.1° |
| C8 | C11 | H2 | H3 | 118.3° | 120.0° |
| C11 | C8 | C9 | H12 | 7.1° | 25.5° |
| C11 | C8 | C9 | H13 | 115.6° | 98.2° |
| C8 | C11 | N33 | H16 | 30.3° | 56.0° |
| C4 | O7 | C8 | C9 | 10.1° | 27.6° |
| C4 | O7 | C8 | C10 | 111.8° | 90.8° |
| O7 | C4 | C3 | H1 | 0.8° | 0.6° |
| C19 | C20 | O28 | C29 | 165.0° | 180.0° |
| C19 | C20 | C21 | H9 | 177.1° | 180.0° |
| O28 | C20 | C19 | F25 | 1.6° | 0.0° |
| C20 | O28 | C29 | F30 | 79.3° | 60.0° |
| C20 | O28 | C29 | F32 | 164.5° | 60.0° |
| O28 | C20 | C21 | H9 | 2.5° | 0.1° |
| C20 | O28 | C29 | H11 | 43.6° | 180.0° |
| C9 | C8 | O7 | C10 | 121.9° | 118.4° |
| C9 | C8 | C10 | C16 | 73.3° | 147.4° |
| C9 | C8 | C10 | C12 | 107.0° | 33.2° |
| C9 | C8 | C11 | H2 | 66.8° | 54.8° |
| C9 | C8 | C11 | H3 | 52.1° | 65.2° |
| C8 | C9 | H12 | H13 | 123.9° | 123.7° |
| O7 | C8 | C10 | C16 | 165.4° | 34.0° |
| O7 | C8 | C10 | C12 | 14.2° | 146.6° |
| O7 | C8 | C11 | H2 | 175.5° | 58.5° |
| O7 | C8 | C11 | H3 | 65.6° | 178.5° |
| O7 | C8 | C9 | H12 | 110.2° | 92.8° |
| O7 | C8 | C9 | H13 | 127.1° | 143.5° |
| C8 | C10 | C16 | C12 | 179.7° | 179.4° |
| C8 | C10 | C16 | C15 | 180.0° | 180.0° |
| C8 | C10 | C12 | C13 | 177.3° | 180.0° |
| C10 | C8 | C11 | H2 | 53.2° | 178.2° |
| C10 | C8 | C11 | H3 | 172.1° | 58.2° |
| C8 | C10 | C12 | H4 | 2.7° | 0.3° |
| C8 | C10 | C16 | H8 | 0.0° | 0.3° |
| C10 | C8 | C9 | H12 | 127.5° | 148.8° |
| C10 | C8 | C9 | H13 | 4.9° | 25.1° |
| F30 | C29 | O28 | F32 | 116.3° | 120.0° |
| F30 | C29 | O28 | H11 | 122.9° | 120.0° |
| F30 | C29 | F32 | H11 | 125.0° | 119.9° |
| O28 | C29 | F32 | H11 | 120.2° | 120.0° |
| C10 | C16 | C15 | H8 | 180.0° | 179.7° |
| C16 | C10 | C12 | C13 | 3.0° | 0.6° |
| C10 | C16 | C15 | C14 | 0.9° | 0.3° |
| C16 | C10 | C12 | H4 | 177.0° | 179.7° |
| C10 | C16 | C15 | H7 | 179.1° | 179.7° |
| C12 | C10 | C16 | C15 | 0.4° | 0.6° |
| C10 | C12 | C13 | H4 | 180.0° | 179.7° |
| C10 | C12 | C13 | C14 | 4.5° | 0.3° |
| C10 | C12 | C13 | H5 | 175.5° | 179.7° |
| C12 | C10 | C16 | H8 | 179.7° | 179.7° |
| C16 | C15 | C14 | H7 | 180.0° | 180.0° |
| C16 | C15 | C14 | C13 | 0.5° | 0.0° |
| C16 | C15 | C14 | H6 | 179.5° | 179.9° |
| C12 | C13 | C14 | C15 | 3.1° | 0.0° |
| C12 | C13 | C14 | H5 | 180.0° | 180.0° |
| C12 | C13 | C14 | H6 | 176.9° | 180.0° |
| C15 | C14 | C13 | H6 | 180.0° | 180.0° |
| C15 | C14 | C13 | H5 | 176.9° | 180.0° |
| C14 | C15 | C16 | H8 | 179.1° | 180.0° |
| C14 | C13 | C12 | H4 | 175.5° | 180.0° |
| C13 | C14 | C15 | H7 | 179.5° | 180.0° |
| H2 | C11 | N33 | H16 | 150.9° | 64.0° |
| H3 | C11 | N33 | H16 | 90.2° | 176.0° |
| H4 | C12 | C13 | H5 | 4.5° | 0.0° |
| H5 | C13 | C14 | H6 | 3.1° | 0.0° |
| H6 | C14 | C15 | H7 | 0.5° | 0.0° |
| H7 | C15 | C16 | H8 | 0.9° | 0.0° |
| H9 | C21 | C22 | H10 | 2.3° | 0.2° |
| H16 | N33 | C34 | H18 | 66.2° | 89.0° |
| H18 | C34 | C35 | H19 | 68.7° | 180.0° |
| H18 | C34 | C35 | H20 | 170.6° | 60.0° |
| H18 | C34 | C39 | H26 | 178.4° | 60.0° |
| H18 | C34 | C39 | H27 | 61.5° | 180.0° |
| H19 | C35 | C36 | H21 | 68.2° | 60.0° |
| H19 | C35 | C36 | H22 | 52.6° | 180.0° |
| H20 | C35 | C36 | H21 | 171.0° | 60.0° |
| H20 | C35 | C36 | H22 | 68.2° | 60.0° |
| H21 | C36 | C37 | H23 | 175.6° | 60.1° |
| H22 | C36 | C37 | H23 | 63.6° | 180.0° |
| H23 | C37 | C38 | H24 | 57.9° | 60.0° |
| H23 | C37 | C38 | H25 | 177.4° | 180.0° |
| H23 | C37 | O40 | H28 | 58.5° | 60.0° |
| H24 | C38 | C39 | H26 | 54.7° | 60.0° |
| H24 | C38 | C39 | H27 | 65.4° | 60.0° |
| H25 | C38 | C39 | H26 | 174.2° | 60.0° |
| H25 | C38 | C39 | H27 | 54.1° | 180.0° |
