W38
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C19 | sing | 1.53Å | 1.53Å | |
| C18 | O17 | sing | 1.43Å | 1.41Å | |
| C19 | N14 | sing | 1.47Å | 1.43Å | |
| O17 | C16 | sing | 1.43Å | 1.43Å | |
| C13 | C11 | sing | 1.55Å | 1.51Å | |
| C13 | C9 | sing | 1.55Å | 1.53Å | |
| N14 | C11 | sing | 1.47Å | 1.46Å | |
| N14 | C15 | sing | 1.47Å | 1.47Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C11 | C10 | sing | 1.54Å | 1.52Å | |
| C11 | C12 | sing | 1.55Å | 1.52Å | |
| C16 | C15 | sing | 1.53Å | 1.51Å | |
| C2 | C4 | sing | 1.51Å | 1.48Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C9 | C10 | sing | 1.54Å | 1.53Å | |
| C9 | C12 | sing | 1.55Å | 1.56Å | |
| C9 | N8 | sing | 1.46Å | 1.43Å | |
| C4 | N8 | sing | 1.35Å | 1.36Å | Aromatic |
| C4 | N5 | doub | 1.30Å | 1.31Å | Aromatic |
| N8 | C7 | sing | 1.37Å | 1.38Å | Aromatic |
| N5 | C6 | sing | 1.35Å | 1.39Å | Aromatic |
| C7 | C6 | doub | 1.36Å | 1.36Å | Aromatic |
| C6 | C20 | sing | 1.48Å | 1.42Å | |
| C20 | C21 | doub | 1.40Å | 1.37Å | Aromatic |
| C20 | C31 | sing | 1.39Å | 1.37Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | N30 | doub | 1.32Å | 1.36Å | Aromatic |
| N30 | C28 | sing | 1.32Å | 1.33Å | Aromatic |
| C22 | C28 | doub | 1.40Å | 1.38Å | Aromatic |
| C22 | O23 | sing | 1.36Å | 1.34Å | |
| C28 | N29 | sing | 1.39Å | 1.39Å | |
| O23 | C24 | sing | 1.43Å | 1.42Å | |
| F27 | C24 | sing | 1.40Å | 1.37Å | |
| C24 | F26 | sing | 1.40Å | 1.32Å | |
| C24 | F25 | sing | 1.40Å | 1.35Å | |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H9 | sing | 1.09Å | 1.10Å | |
| C3 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C2 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.08Å | 1.08Å | |
| N29 | H25 | sing | 0.97Å | 1.00Å | |
| N29 | H26 | sing | 0.97Å | 1.00Å | |
| C31 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C18 | O17 | 109.5° | 109.2° |
| C18 | C19 | N14 | 108.0° | 109.3° |
| C19 | C18 | H20 | 109.4° | 109.5° |
| C19 | C18 | H21 | 109.4° | 109.6° |
| C18 | C19 | H22 | 109.9° | 109.5° |
| C18 | C19 | H23 | 109.8° | 109.5° |
| C18 | O17 | C16 | 115.4° | 113.7° |
| O17 | C18 | H20 | 109.5° | 109.5° |
| O17 | C18 | H21 | 109.5° | 109.5° |
| C19 | N14 | C11 | 116.2° | 111.0° |
| C19 | N14 | C15 | 115.2° | 110.8° |
| N14 | C19 | H22 | 109.9° | 109.5° |
| N14 | C19 | H23 | 109.9° | 109.5° |
| O17 | C16 | C15 | 112.8° | 109.3° |
| O17 | C16 | H18 | 108.6° | 109.6° |
| O17 | C16 | H19 | 108.7° | 109.5° |
| C11 | C13 | C9 | 76.1° | 78.6° |
| C13 | C11 | N14 | 128.7° | 129.9° |
| C13 | C11 | C10 | 86.7° | 84.5° |
| C13 | C11 | C12 | 88.3° | 83.2° |
| C11 | C13 | H6 | 117.1° | 115.0° |
| C11 | C13 | H7 | 117.0° | 115.0° |
| C13 | C9 | C10 | 86.0° | 84.5° |
| C13 | C9 | C12 | 86.5° | 83.2° |
| C13 | C9 | N8 | 127.9° | 129.9° |
| C9 | C13 | H6 | 117.1° | 114.9° |
| C9 | C13 | H7 | 117.0° | 115.0° |
| C11 | N14 | C15 | 111.3° | 111.0° |
| N14 | C11 | C10 | 121.3° | 129.1° |
| N14 | C11 | C12 | 131.2° | 129.1° |
| N14 | C15 | C16 | 110.1° | 109.2° |
| N14 | C15 | H16 | 109.3° | 109.5° |
| N14 | C15 | H17 | 109.3° | 109.5° |
| C3 | C2 | C4 | 114.0° | 109.4° |
| C3 | C2 | C1 | 105.5° | 109.4° |
| C2 | C3 | H8 | 109.5° | 109.5° |
| C2 | C3 | H9 | 109.5° | 109.5° |
| C2 | C3 | H10 | 109.5° | 109.5° |
| C3 | C2 | H14 | 110.6° | 109.5° |
| C10 | C11 | C12 | 86.2° | 84.5° |
| C11 | C10 | C9 | 75.5° | 78.9° |
| C11 | C10 | H2 | 117.2° | 115.0° |
| C11 | C10 | H3 | 117.1° | 114.9° |
| C11 | C12 | C9 | 75.1° | 78.6° |
| C11 | C12 | H4 | 117.2° | 115.0° |
| C11 | C12 | H5 | 117.2° | 114.9° |
| C16 | C15 | H16 | 109.3° | 109.5° |
| C16 | C15 | H17 | 109.3° | 109.6° |
| C15 | C16 | H18 | 108.6° | 109.5° |
| C15 | C16 | H19 | 108.6° | 109.5° |
| C4 | C2 | C1 | 104.8° | 109.5° |
| C2 | C4 | N8 | 120.9° | 125.4° |
| C2 | C4 | N5 | 127.6° | 125.6° |
| C4 | C2 | H14 | 111.2° | 109.5° |
| C2 | C1 | H11 | 109.5° | 109.5° |
| C2 | C1 | H12 | 109.5° | 109.4° |
| C2 | C1 | H13 | 109.5° | 109.5° |
| C1 | C2 | H14 | 110.4° | 109.5° |
| C10 | C9 | C12 | 84.5° | 84.5° |
| C10 | C9 | N8 | 128.7° | 129.1° |
| C9 | C10 | H2 | 117.2° | 115.0° |
| C9 | C10 | H3 | 117.1° | 114.9° |
| C12 | C9 | N8 | 128.2° | 129.1° |
| C9 | C12 | H4 | 117.3° | 115.0° |
| C9 | C12 | H5 | 117.2° | 114.9° |
| C9 | N8 | C4 | 129.8° | 126.4° |
| C9 | N8 | C7 | 122.8° | 126.3° |
| N8 | C4 | N5 | 111.5° | 109.0° |
| C4 | N8 | C7 | 107.4° | 107.4° |
| C4 | N5 | C6 | 105.3° | 109.2° |
| N8 | C7 | C6 | 105.5° | 106.7° |
| N8 | C7 | H1 | 127.2° | 126.7° |
| N5 | C6 | C7 | 110.3° | 107.7° |
| N5 | C6 | C20 | 124.7° | 126.2° |
| C7 | C6 | C20 | 125.0° | 126.1° |
| C6 | C7 | H1 | 127.3° | 126.6° |
| C6 | C20 | C21 | 120.2° | 120.4° |
| C6 | C20 | C31 | 122.4° | 120.4° |
| C21 | C20 | C31 | 117.4° | 119.2° |
| C20 | C21 | C22 | 118.2° | 118.3° |
| C20 | C21 | H24 | 120.9° | 120.9° |
| C20 | C31 | N30 | 125.3° | 120.7° |
| C20 | C31 | H27 | 117.4° | 119.6° |
| C21 | C22 | C28 | 121.1° | 119.2° |
| C21 | C22 | O23 | 125.9° | 120.4° |
| C22 | C21 | H24 | 120.9° | 120.8° |
| C31 | N30 | C28 | 116.7° | 121.8° |
| N30 | C31 | H27 | 117.4° | 119.6° |
| N30 | C28 | C22 | 121.2° | 120.8° |
| N30 | C28 | N29 | 122.6° | 119.6° |
| C28 | C22 | O23 | 113.1° | 120.4° |
| C22 | C28 | N29 | 116.1° | 119.6° |
| C22 | O23 | C24 | 116.3° | 117.0° |
| C28 | N29 | H25 | 109.5° | 120.0° |
| C28 | N29 | H26 | 109.5° | 120.0° |
| O23 | C24 | F27 | 117.2° | 109.5° |
| O23 | C24 | F26 | 105.8° | 109.4° |
| O23 | C24 | F25 | 111.3° | 109.5° |
| F27 | C24 | F26 | 99.2° | 109.5° |
| F27 | C24 | F25 | 114.3° | 109.5° |
| F26 | C24 | F25 | 107.5° | 109.5° |
| H2 | C10 | H3 | 109.5° | 113.8° |
| H4 | C12 | H5 | 109.5° | 113.9° |
| H6 | C13 | H7 | 109.5° | 113.9° |
| H8 | C3 | H9 | 109.5° | 109.5° |
| H8 | C3 | H10 | 109.5° | 109.4° |
| H9 | C3 | H10 | 109.5° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.5° |
| H11 | C1 | H13 | 109.5° | 109.5° |
| H12 | C1 | H13 | 109.5° | 109.4° |
| H16 | C15 | H17 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.4° |
| H20 | C18 | H21 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 109.5° |
| H25 | N29 | H26 | 109.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C18 | O17 | H20 | 120.0° | 119.9° |
| C19 | C18 | O17 | H21 | 120.0° | 120.0° |
| C18 | C19 | N14 | H22 | 119.8° | 119.9° |
| C18 | C19 | N14 | H23 | 119.7° | 120.0° |
| C19 | C18 | O17 | C16 | 57.0° | 58.7° |
| C18 | C19 | N14 | C11 | 169.4° | 177.6° |
| C18 | C19 | N14 | C15 | 57.8° | 58.6° |
| C19 | C18 | H20 | H21 | 120.0° | 120.2° |
| C18 | C19 | H22 | H23 | 120.7° | 120.1° |
| O17 | C18 | C19 | N14 | 58.2° | 56.8° |
| C18 | O17 | C16 | C15 | 50.9° | 58.7° |
| C18 | O17 | C16 | H18 | 171.4° | 61.3° |
| C18 | O17 | C16 | H19 | 69.6° | 178.7° |
| O17 | C18 | H20 | H21 | 120.0° | 120.1° |
| O17 | C18 | C19 | H22 | 178.0° | 63.1° |
| O17 | C18 | C19 | H23 | 61.6° | 176.8° |
| C19 | N14 | C11 | C13 | 35.8° | 64.9° |
| C19 | N14 | C11 | C15 | 134.6° | 123.7° |
| C19 | N14 | C11 | C10 | 149.5° | 56.4° |
| C19 | N14 | C11 | C12 | 95.0° | 176.3° |
| C19 | N14 | C15 | C16 | 51.4° | 58.6° |
| C19 | N14 | C15 | H16 | 171.5° | 178.5° |
| C19 | N14 | C15 | H17 | 68.7° | 61.4° |
| N14 | C19 | C18 | H20 | 178.2° | 63.1° |
| N14 | C19 | C18 | H21 | 61.8° | 176.7° |
| N14 | C19 | H22 | H23 | 120.7° | 120.1° |
| O17 | C16 | C15 | N14 | 44.7° | 56.9° |
| O17 | C16 | C15 | H18 | 120.5° | 120.0° |
| O17 | C16 | C15 | H19 | 120.5° | 119.9° |
| O17 | C16 | C15 | H16 | 164.8° | 176.8° |
| O17 | C16 | C15 | H17 | 75.4° | 63.1° |
| O17 | C16 | H18 | H19 | 118.5° | 120.1° |
| C16 | O17 | C18 | H20 | 177.0° | 61.3° |
| C16 | O17 | C18 | H21 | 63.0° | 178.6° |
| C11 | C13 | C9 | H6 | 113.5° | 112.4° |
| C11 | C13 | C9 | H7 | 113.5° | 112.4° |
| C13 | C11 | N14 | C10 | 113.7° | 121.2° |
| C13 | C11 | N14 | C12 | 130.8° | 118.8° |
| C13 | C11 | N14 | C15 | 170.4° | 58.8° |
| C13 | C11 | C10 | C12 | 88.6° | 83.7° |
| C11 | C13 | C9 | C10 | 43.0° | 41.7° |
| C11 | C13 | C9 | C12 | 41.7° | 43.4° |
| C11 | C13 | C9 | N8 | 179.2° | 179.9° |
| C13 | C11 | C10 | H2 | 156.6° | 154.4° |
| C13 | C11 | C10 | H3 | 70.3° | 70.6° |
| C13 | C11 | C12 | H4 | 71.1° | 69.1° |
| C13 | C11 | C12 | H5 | 155.5° | 155.7° |
| C11 | C13 | H6 | H7 | 136.2° | 135.8° |
| C9 | C13 | C11 | N14 | 171.7° | 179.9° |
| C13 | C9 | C10 | C12 | 86.8° | 83.7° |
| C13 | C9 | C10 | N8 | 137.2° | 138.8° |
| C13 | C9 | C12 | N8 | 137.3° | 137.4° |
| C13 | C9 | N8 | C4 | 76.4° | 58.7° |
| C13 | C9 | N8 | C7 | 102.5° | 121.2° |
| C13 | C9 | C10 | H2 | 156.2° | 154.4° |
| C13 | C9 | C10 | H3 | 70.6° | 70.6° |
| C13 | C9 | C12 | H4 | 71.4° | 69.1° |
| C13 | C9 | C12 | H5 | 155.2° | 155.7° |
| C9 | C13 | H6 | H7 | 136.2° | 135.6° |
| N14 | C11 | C10 | C12 | 137.1° | 137.5° |
| C11 | N14 | C15 | C16 | 173.6° | 177.6° |
| N14 | C11 | C10 | C9 | 177.5° | 179.3° |
| N14 | C11 | C12 | C9 | 174.0° | 179.2° |
| N14 | C11 | C10 | H2 | 69.1° | 66.8° |
| N14 | C11 | C10 | H3 | 64.1° | 68.2° |
| N14 | C11 | C12 | H4 | 72.7° | 68.4° |
| N14 | C11 | C12 | H5 | 60.7° | 66.8° |
| N14 | C11 | C13 | H6 | 58.1° | 67.5° |
| N14 | C11 | C13 | H7 | 74.8° | 67.7° |
| C11 | N14 | C15 | H16 | 53.5° | 57.7° |
| C11 | N14 | C15 | H17 | 66.3° | 62.4° |
| C11 | N14 | C19 | H22 | 49.6° | 62.5° |
| C11 | N14 | C19 | H23 | 70.9° | 57.6° |
| C15 | N14 | C11 | C10 | 75.9° | 180.0° |
| C15 | N14 | C11 | C12 | 39.5° | 60.0° |
| N14 | C15 | C16 | H16 | 120.1° | 119.9° |
| N14 | C15 | C16 | H17 | 120.1° | 119.9° |
| N14 | C15 | H16 | H17 | 119.7° | 120.1° |
| N14 | C15 | C16 | H18 | 165.1° | 63.1° |
| N14 | C15 | C16 | H19 | 75.9° | 176.8° |
| C15 | N14 | C19 | H22 | 177.6° | 61.3° |
| C15 | N14 | C19 | H23 | 61.9° | 178.6° |
| C3 | C2 | C4 | C1 | 114.9° | 119.9° |
| C3 | C2 | C4 | H14 | 125.8° | 120.0° |
| C3 | C2 | C1 | H14 | 119.5° | 120.0° |
| C3 | C2 | C4 | N8 | 158.6° | 120.0° |
| C3 | C2 | C4 | N5 | 20.7° | 59.7° |
| C2 | C3 | H8 | H9 | 120.0° | 120.1° |
| C2 | C3 | H8 | H10 | 120.0° | 120.0° |
| C2 | C3 | H9 | H10 | 120.0° | 120.0° |
| C3 | C2 | C1 | H11 | 180.0° | 60.0° |
| C3 | C2 | C1 | H12 | 60.0° | 180.0° |
| C3 | C2 | C1 | H13 | 60.0° | 60.1° |
| C11 | C10 | C9 | H2 | 113.4° | 112.5° |
| C11 | C10 | C9 | H3 | 113.4° | 112.5° |
| C10 | C11 | C12 | C9 | 44.6° | 41.7° |
| C11 | C10 | C9 | N8 | 180.0° | 179.4° |
| C11 | C10 | H2 | H3 | 136.5° | 135.5° |
| C10 | C11 | C12 | H4 | 158.0° | 154.2° |
| C10 | C11 | C12 | H5 | 68.7° | 70.6° |
| C10 | C11 | C13 | H6 | 70.3° | 70.6° |
| C10 | C11 | C13 | H7 | 156.8° | 154.1° |
| C11 | C12 | C9 | H4 | 113.3° | 112.4° |
| C11 | C12 | C9 | H5 | 113.3° | 112.4° |
| C11 | C12 | C9 | N8 | 179.2° | 179.2° |
| C12 | C11 | C10 | H2 | 68.0° | 70.7° |
| C12 | C11 | C10 | H3 | 158.8° | 154.4° |
| C11 | C12 | H4 | H5 | 136.7° | 135.7° |
| C12 | C11 | C13 | H6 | 156.6° | 155.7° |
| C12 | C11 | C13 | H7 | 70.5° | 69.0° |
| C16 | C15 | H16 | H17 | 119.7° | 120.2° |
| C15 | C16 | H18 | H19 | 118.5° | 120.1° |
| C4 | C2 | C1 | H14 | 119.8° | 120.1° |
| C2 | C4 | N8 | C9 | 0.2° | 0.3° |
| C2 | C4 | N8 | N5 | 179.4° | 179.7° |
| C2 | C4 | N8 | C7 | 179.2° | 179.8° |
| C2 | C4 | N5 | C6 | 179.1° | 179.7° |
| C4 | C2 | C3 | H8 | 180.0° | 60.1° |
| C4 | C2 | C3 | H9 | 60.0° | 60.0° |
| C4 | C2 | C3 | H10 | 60.0° | 180.0° |
| C4 | C2 | C1 | H11 | 59.3° | 59.9° |
| C4 | C2 | C1 | H12 | 179.3° | 60.1° |
| C4 | C2 | C1 | H13 | 60.7° | 180.0° |
| C1 | C2 | C4 | N8 | 86.5° | 120.1° |
| C1 | C2 | C4 | N5 | 94.2° | 60.3° |
| C1 | C2 | C3 | H8 | 65.6° | 180.0° |
| C1 | C2 | C3 | H9 | 174.4° | 60.0° |
| C1 | C2 | C3 | H10 | 54.4° | 60.1° |
| C2 | C1 | H11 | H12 | 120.0° | 120.0° |
| C2 | C1 | H11 | H13 | 120.0° | 120.0° |
| C2 | C1 | H12 | H13 | 120.0° | 120.0° |
| C10 | C9 | C12 | N8 | 136.3° | 137.5° |
| C10 | C9 | N8 | C4 | 44.4° | 179.9° |
| C10 | C9 | N8 | C7 | 136.7° | 0.0° |
| C9 | C10 | H2 | H3 | 136.5° | 135.5° |
| C10 | C9 | C12 | H4 | 157.8° | 154.2° |
| C10 | C9 | C12 | H5 | 68.8° | 70.6° |
| C10 | C9 | C13 | H6 | 70.5° | 70.6° |
| C10 | C9 | C13 | H7 | 156.5° | 154.2° |
| C12 | C9 | N8 | C4 | 162.7° | 60.0° |
| C12 | C9 | N8 | C7 | 18.4° | 120.0° |
| C12 | C9 | C10 | H2 | 69.4° | 70.7° |
| C12 | C9 | C10 | H3 | 157.5° | 154.3° |
| C9 | C12 | H4 | H5 | 136.7° | 135.6° |
| C12 | C9 | C13 | H6 | 155.3° | 155.7° |
| C12 | C9 | C13 | H7 | 71.8° | 69.1° |
| C9 | N8 | C4 | C7 | 179.0° | 179.9° |
| C9 | N8 | C4 | N5 | 179.3° | 180.0° |
| C9 | N8 | C7 | C6 | 179.2° | 180.0° |
| C9 | N8 | C7 | H1 | 0.8° | 0.0° |
| N8 | C9 | C10 | H2 | 66.6° | 66.8° |
| N8 | C9 | C10 | H3 | 66.6° | 68.1° |
| N8 | C9 | C12 | H4 | 65.9° | 68.3° |
| N8 | C9 | C12 | H5 | 67.5° | 66.9° |
| N8 | C9 | C13 | H6 | 67.2° | 67.5° |
| N8 | C9 | C13 | H7 | 65.7° | 67.7° |
| N8 | C4 | N5 | C6 | 0.3° | 0.1° |
| C4 | N8 | C7 | C6 | 0.1° | 0.1° |
| C4 | N8 | C7 | H1 | 179.9° | 180.0° |
| N8 | C4 | C2 | H14 | 32.8° | 0.1° |
| N5 | C4 | N8 | C7 | 0.3° | 0.1° |
| C4 | N5 | C6 | C7 | 0.2° | 0.0° |
| C4 | N5 | C6 | C20 | 177.0° | 180.0° |
| N5 | C4 | C2 | H14 | 146.5° | 179.7° |
| N8 | C7 | C6 | N5 | 0.1° | 0.0° |
| N8 | C7 | C6 | H1 | 180.0° | 180.0° |
| N8 | C7 | C6 | C20 | 177.2° | 179.9° |
| N5 | C6 | C7 | C20 | 177.2° | 180.0° |
| N5 | C6 | C20 | C21 | 4.4° | 0.1° |
| N5 | C6 | C20 | C31 | 174.4° | 179.7° |
| N5 | C6 | C7 | H1 | 180.0° | 180.0° |
| C7 | C6 | C20 | C21 | 178.8° | 180.0° |
| C7 | C6 | C20 | C31 | 2.4° | 0.3° |
| C6 | C20 | C21 | C31 | 178.9° | 179.8° |
| C6 | C20 | C21 | C22 | 177.6° | 180.0° |
| C6 | C20 | C31 | N30 | 179.5° | 179.7° |
| C20 | C6 | C7 | H1 | 2.8° | 0.0° |
| C6 | C20 | C21 | H24 | 2.4° | 0.0° |
| C6 | C20 | C31 | H27 | 0.5° | 0.0° |
| C20 | C21 | C22 | H24 | 180.0° | 179.9° |
| C21 | C20 | C31 | N30 | 1.7° | 0.5° |
| C20 | C21 | C22 | C28 | 3.0° | 0.0° |
| C20 | C21 | C22 | O23 | 177.8° | 180.0° |
| C21 | C20 | C31 | H27 | 178.3° | 179.7° |
| C31 | C20 | C21 | C22 | 3.6° | 0.3° |
| C20 | C31 | N30 | H27 | 180.0° | 179.8° |
| C20 | C31 | N30 | C28 | 1.0° | 0.5° |
| C31 | C20 | C21 | H24 | 176.4° | 179.8° |
| C21 | C22 | C28 | N30 | 0.3° | 0.0° |
| C21 | C22 | C28 | O23 | 179.2° | 179.9° |
| C21 | C22 | C28 | N29 | 179.2° | 180.0° |
| C21 | C22 | O23 | C24 | 54.0° | 0.1° |
| C31 | N30 | C28 | C22 | 1.6° | 0.3° |
| C31 | N30 | C28 | N29 | 177.1° | 179.7° |
| N30 | C28 | C22 | N29 | 178.8° | 180.0° |
| N30 | C28 | C22 | O23 | 179.6° | 180.0° |
| N30 | C28 | N29 | H25 | 0.0° | 180.0° |
| N30 | C28 | N29 | H26 | 120.0° | 0.0° |
| C28 | N30 | C31 | H27 | 179.0° | 179.7° |
| C28 | C22 | O23 | C24 | 126.8° | 180.0° |
| C28 | C22 | C21 | H24 | 177.0° | 180.0° |
| C22 | C28 | N29 | H25 | 178.8° | 0.0° |
| C22 | C28 | N29 | H26 | 58.9° | 180.0° |
| O23 | C22 | C28 | N29 | 1.6° | 0.0° |
| C22 | O23 | C24 | F27 | 72.0° | 180.0° |
| C22 | O23 | C24 | F26 | 178.6° | 60.0° |
| C22 | O23 | C24 | F25 | 62.2° | 59.9° |
| O23 | C22 | C21 | H24 | 2.2° | 0.1° |
| C28 | N29 | H25 | H26 | 120.0° | 180.0° |
| O23 | C24 | F27 | F26 | 113.1° | 119.9° |
| O23 | C24 | F27 | F25 | 132.8° | 120.0° |
| O23 | C24 | F26 | F25 | 119.0° | 120.0° |
| F27 | C24 | F26 | F25 | 119.3° | 120.1° |
| H8 | C3 | H9 | H10 | 120.0° | 119.9° |
| H8 | C3 | C2 | H14 | 53.9° | 60.0° |
| H9 | C3 | C2 | H14 | 66.1° | 180.0° |
| H10 | C3 | C2 | H14 | 173.9° | 59.9° |
| H11 | C1 | H12 | H13 | 120.0° | 120.1° |
| H11 | C1 | C2 | H14 | 60.5° | 180.0° |
| H12 | C1 | C2 | H14 | 59.5° | 60.0° |
| H13 | C1 | C2 | H14 | 179.5° | 59.9° |
| H16 | C15 | C16 | H18 | 74.8° | 56.8° |
| H16 | C15 | C16 | H19 | 44.2° | 63.3° |
| H17 | C15 | C16 | H18 | 45.0° | 176.9° |
| H17 | C15 | C16 | H19 | 164.0° | 56.9° |
| H20 | C18 | C19 | H22 | 62.0° | 177.0° |
| H20 | C18 | C19 | H23 | 58.4° | 56.9° |
| H21 | C18 | C19 | H22 | 58.0° | 56.8° |
| H21 | C18 | C19 | H23 | 178.4° | 63.3° |
