A1AIT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N45 | C02 | sing | 1.35Å | 1.41Å | |
| N45 | C44 | sing | 1.40Å | 1.44Å | |
| O01 | C02 | doub | 1.22Å | 1.18Å | |
| C02 | O03 | sing | 1.34Å | 1.40Å | |
| C43 | C44 | doub | 1.39Å | 1.40Å | Aromatic |
| C43 | C42 | sing | 1.38Å | 1.39Å | Aromatic |
| C44 | C04 | sing | 1.39Å | 1.38Å | Aromatic |
| O03 | C04 | sing | 1.35Å | 1.45Å | |
| C42 | C41 | doub | 1.38Å | 1.40Å | Aromatic |
| C04 | C05 | doub | 1.40Å | 1.40Å | Aromatic |
| C41 | C05 | sing | 1.39Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.48Å | 1.52Å | |
| C06 | N07 | doub | 1.32Å | 1.34Å | Aromatic |
| C06 | C10 | sing | 1.40Å | 1.41Å | Aromatic |
| N07 | N08 | sing | 1.29Å | 1.37Å | Aromatic |
| F29 | C26 | sing | 1.40Å | 1.36Å | |
| F37 | C35 | sing | 1.40Å | 1.36Å | |
| F27 | C26 | sing | 1.40Å | 1.36Å | |
| C10 | C11 | sing | 1.50Å | 1.53Å | |
| C10 | C09 | doub | 1.38Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C11 | N33 | sing | 1.47Å | 1.43Å | |
| N08 | C09 | sing | 1.37Å | 1.32Å | Aromatic |
| C26 | F28 | sing | 1.40Å | 1.36Å | |
| C26 | C25 | sing | 1.51Å | 1.51Å | |
| F36 | C35 | sing | 1.40Å | 1.36Å | |
| C09 | C39 | sing | 1.47Å | 1.53Å | |
| C13 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C38 | sing | 1.53Å | 1.52Å | |
| C35 | C34 | sing | 1.53Å | 1.52Å | |
| C12 | C32 | sing | 1.38Å | 1.38Å | Aromatic |
| N33 | C39 | sing | 1.34Å | 1.44Å | |
| N33 | C34 | sing | 1.47Å | 1.45Å | |
| C14 | C15 | doub | 1.39Å | 1.38Å | Aromatic |
| C39 | O40 | doub | 1.22Å | 1.18Å | |
| C25 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C30 | C17 | sing | 1.39Å | 1.38Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.37Å | Aromatic |
| C24 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C31 | sing | 1.39Å | 1.37Å | Aromatic |
| C15 | O16 | sing | 1.36Å | 1.40Å | |
| C17 | O16 | sing | 1.36Å | 1.40Å | |
| C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.51Å | 1.52Å | |
| F21 | C20 | sing | 1.40Å | 1.36Å | |
| C20 | F22 | sing | 1.40Å | 1.36Å | |
| C20 | F23 | sing | 1.40Å | 1.36Å | |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.08Å | 1.08Å | |
| C14 | H3 | sing | 1.08Å | 1.08Å | |
| C30 | H4 | sing | 1.08Å | 1.08Å | |
| C34 | H5 | sing | 1.09Å | 1.10Å | |
| C34 | H6 | sing | 1.09Å | 1.10Å | |
| C38 | H7 | sing | 1.09Å | 1.10Å | |
| C38 | H8 | sing | 1.09Å | 1.10Å | |
| C38 | H9 | sing | 1.09Å | 1.10Å | |
| C43 | H10 | sing | 1.08Å | 1.08Å | |
| C18 | H11 | sing | 1.08Å | 1.08Å | |
| C24 | H12 | sing | 1.08Å | 1.08Å | |
| C31 | H13 | sing | 1.08Å | 1.08Å | |
| C32 | H14 | sing | 1.08Å | 1.08Å | |
| C41 | H15 | sing | 1.08Å | 1.08Å | |
| C42 | H16 | sing | 1.08Å | 1.08Å | |
| N45 | H18 | sing | 0.97Å | 1.00Å | |
| N08 | H17 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | N45 | C44 | 108.1° | 107.5° |
| N45 | C02 | O01 | 126.3° | 125.3° |
| N45 | C02 | O03 | 107.9° | 109.4° |
| C02 | N45 | H18 | 126.0° | 126.3° |
| N45 | C44 | C43 | 132.5° | 133.3° |
| N45 | C44 | C04 | 107.8° | 106.6° |
| C44 | N45 | H18 | 126.0° | 126.3° |
| O01 | C02 | O03 | 125.8° | 125.3° |
| C02 | O03 | C04 | 108.0° | 109.2° |
| C44 | C43 | C42 | 120.0° | 120.1° |
| C43 | C44 | C04 | 119.6° | 120.1° |
| C44 | C43 | H10 | 120.0° | 119.9° |
| C43 | C42 | C41 | 120.4° | 120.3° |
| C42 | C43 | H10 | 120.0° | 120.0° |
| C43 | C42 | H16 | 119.8° | 119.9° |
| C44 | C04 | O03 | 108.2° | 107.4° |
| C44 | C04 | C05 | 120.4° | 119.6° |
| O03 | C04 | C05 | 131.3° | 133.0° |
| C42 | C41 | C05 | 119.3° | 120.2° |
| C42 | C41 | H15 | 120.4° | 119.9° |
| C41 | C42 | H16 | 119.8° | 119.8° |
| C04 | C05 | C41 | 120.3° | 119.7° |
| C04 | C05 | C06 | 117.1° | 120.1° |
| C41 | C05 | C06 | 122.5° | 120.2° |
| C05 | C41 | H15 | 120.4° | 119.9° |
| C05 | C06 | N07 | 124.7° | 126.3° |
| C05 | C06 | C10 | 127.6° | 126.3° |
| N07 | C06 | C10 | 107.6° | 107.4° |
| C06 | N07 | N08 | 107.6° | 110.7° |
| C06 | C10 | C11 | 145.5° | 147.5° |
| C06 | C10 | C09 | 106.5° | 105.8° |
| N07 | N08 | C09 | 110.0° | 109.9° |
| N07 | N08 | H17 | 125.0° | 125.1° |
| F29 | C26 | F27 | 111.2° | 109.5° |
| F29 | C26 | F28 | 109.9° | 109.5° |
| F29 | C26 | C25 | 108.6° | 109.5° |
| F37 | C35 | F36 | 110.0° | 109.5° |
| F37 | C35 | C38 | 110.6° | 109.5° |
| F37 | C35 | C34 | 109.6° | 109.5° |
| F27 | C26 | F28 | 109.1° | 109.5° |
| F27 | C26 | C25 | 109.5° | 109.4° |
| C11 | C10 | C09 | 107.9° | 106.7° |
| C10 | C11 | C12 | 109.0° | 110.1° |
| C10 | C11 | N33 | 107.6° | 106.1° |
| C10 | C11 | H1 | 111.6° | 110.1° |
| C10 | C09 | N08 | 108.3° | 106.1° |
| C10 | C09 | C39 | 108.4° | 108.6° |
| C12 | C11 | N33 | 103.1° | 110.2° |
| C11 | C12 | C13 | 123.2° | 120.0° |
| C11 | C12 | C32 | 117.1° | 119.9° |
| C12 | C11 | H1 | 111.8° | 110.1° |
| C11 | N33 | C39 | 108.5° | 108.3° |
| C11 | N33 | C34 | 126.0° | 125.8° |
| N33 | C11 | H1 | 113.3° | 110.2° |
| N08 | C09 | C39 | 143.3° | 145.3° |
| C09 | N08 | H17 | 125.0° | 125.1° |
| F28 | C26 | C25 | 108.5° | 109.5° |
| C26 | C25 | C30 | 120.5° | 120.0° |
| C26 | C25 | C24 | 118.8° | 120.0° |
| F36 | C35 | C38 | 107.8° | 109.4° |
| F36 | C35 | C34 | 109.5° | 109.5° |
| C09 | C39 | N33 | 107.4° | 110.4° |
| C09 | C39 | O40 | 125.9° | 124.8° |
| C12 | C13 | C14 | 119.9° | 120.0° |
| C13 | C12 | C32 | 119.7° | 120.2° |
| C12 | C13 | H2 | 120.1° | 120.0° |
| C13 | C14 | C15 | 119.7° | 119.9° |
| C14 | C13 | H2 | 120.1° | 119.9° |
| C13 | C14 | H3 | 120.2° | 120.0° |
| C38 | C35 | C34 | 109.3° | 109.4° |
| C35 | C38 | H7 | 109.5° | 109.5° |
| C35 | C38 | H8 | 109.5° | 109.4° |
| C35 | C38 | H9 | 109.5° | 109.4° |
| C35 | C34 | N33 | 111.9° | 109.5° |
| C35 | C34 | H5 | 108.9° | 109.5° |
| C35 | C34 | H6 | 108.9° | 109.5° |
| C12 | C32 | C31 | 120.5° | 120.0° |
| C12 | C32 | H14 | 119.7° | 120.0° |
| C39 | N33 | C34 | 125.4° | 125.9° |
| N33 | C39 | O40 | 126.7° | 124.8° |
| N33 | C34 | H5 | 108.8° | 109.5° |
| N33 | C34 | H6 | 108.9° | 109.4° |
| C14 | C15 | C31 | 120.1° | 119.9° |
| C14 | C15 | O16 | 125.3° | 120.0° |
| C15 | C14 | H3 | 120.1° | 120.1° |
| C30 | C25 | C24 | 120.7° | 120.0° |
| C25 | C30 | C17 | 119.3° | 120.0° |
| C25 | C30 | H4 | 120.3° | 120.0° |
| C25 | C24 | C19 | 120.0° | 120.1° |
| C25 | C24 | H12 | 120.0° | 119.9° |
| C30 | C17 | O16 | 120.5° | 120.1° |
| C30 | C17 | C18 | 120.3° | 119.9° |
| C17 | C30 | H4 | 120.3° | 120.0° |
| C32 | C31 | C15 | 120.2° | 120.0° |
| C32 | C31 | H13 | 119.9° | 120.0° |
| C31 | C32 | H14 | 119.8° | 120.0° |
| C24 | C19 | C18 | 119.9° | 120.0° |
| C24 | C19 | C20 | 119.0° | 119.9° |
| C19 | C24 | H12 | 120.0° | 120.0° |
| C31 | C15 | O16 | 114.7° | 120.1° |
| C15 | C31 | H13 | 119.9° | 120.0° |
| C15 | O16 | C17 | 119.6° | 117.9° |
| O16 | C17 | C18 | 119.0° | 120.0° |
| C17 | C18 | C19 | 119.7° | 120.0° |
| C17 | C18 | H11 | 120.1° | 120.1° |
| C18 | C19 | C20 | 121.1° | 120.0° |
| C19 | C18 | H11 | 120.2° | 120.0° |
| C19 | C20 | F21 | 109.9° | 109.5° |
| C19 | C20 | F22 | 109.6° | 109.4° |
| C19 | C20 | F23 | 108.3° | 109.5° |
| F21 | C20 | F22 | 109.9° | 109.4° |
| F21 | C20 | F23 | 109.7° | 109.5° |
| F22 | C20 | F23 | 109.5° | 109.5° |
| H5 | C34 | H6 | 109.5° | 109.5° |
| H7 | C38 | H8 | 109.5° | 109.5° |
| H7 | C38 | H9 | 109.5° | 109.5° |
| H8 | C38 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | N45 | C44 | H18 | 180.0° | 179.9° |
| N45 | C02 | O01 | O03 | 179.9° | 179.9° |
| C02 | N45 | C44 | C43 | 180.0° | 180.0° |
| C02 | N45 | C44 | C04 | 0.2° | 0.1° |
| N45 | C02 | O03 | C04 | 0.1° | 0.1° |
| C44 | N45 | C02 | O01 | 179.9° | 180.0° |
| C44 | N45 | C02 | O03 | 0.2° | 0.1° |
| N45 | C44 | C43 | C04 | 179.9° | 179.9° |
| N45 | C44 | C43 | C42 | 179.9° | 180.0° |
| N45 | C44 | C04 | O03 | 0.1° | 0.0° |
| N45 | C44 | C04 | C05 | 179.0° | 179.9° |
| N45 | C44 | C43 | H10 | 0.1° | 0.2° |
| O01 | C02 | O03 | C04 | 180.0° | 180.0° |
| O01 | C02 | N45 | H18 | 0.1° | 0.1° |
| C02 | O03 | C04 | C44 | 0.0° | 0.0° |
| C02 | O03 | C04 | C05 | 179.0° | 179.9° |
| O03 | C02 | N45 | H18 | 179.8° | 180.0° |
| C44 | C43 | C42 | H10 | 180.0° | 179.8° |
| C43 | C44 | C04 | O03 | 180.0° | 180.0° |
| C44 | C43 | C42 | C41 | 0.0° | 0.0° |
| C43 | C44 | C04 | C05 | 0.9° | 0.1° |
| C44 | C43 | C42 | H16 | 180.0° | 180.0° |
| C43 | C44 | N45 | H18 | 0.0° | 0.1° |
| C42 | C43 | C44 | C04 | 0.1° | 0.1° |
| C43 | C42 | C41 | H16 | 180.0° | 180.0° |
| C43 | C42 | C41 | C05 | 1.0° | 0.0° |
| C43 | C42 | C41 | H15 | 179.0° | 179.9° |
| C44 | C04 | O03 | C05 | 179.0° | 179.9° |
| C44 | C04 | C05 | C41 | 1.9° | 0.1° |
| C44 | C04 | C05 | C06 | 178.2° | 180.0° |
| C04 | C44 | C43 | H10 | 179.9° | 179.7° |
| C04 | C44 | N45 | H18 | 179.8° | 180.0° |
| O03 | C04 | C05 | C41 | 179.2° | 180.0° |
| O03 | C04 | C05 | C06 | 2.9° | 0.1° |
| C42 | C41 | C05 | C04 | 2.0° | 0.0° |
| C42 | C41 | C05 | H15 | 180.0° | 180.0° |
| C42 | C41 | C05 | C06 | 178.1° | 179.9° |
| C41 | C42 | C43 | H10 | 180.0° | 179.8° |
| C04 | C05 | C41 | C06 | 176.1° | 179.9° |
| C04 | C05 | C06 | N07 | 18.7° | 6.5° |
| C04 | C05 | C06 | C10 | 157.2° | 173.6° |
| C04 | C05 | C41 | H15 | 178.0° | 180.0° |
| C41 | C05 | C06 | N07 | 165.1° | 173.6° |
| C41 | C05 | C06 | C10 | 19.0° | 6.3° |
| C05 | C41 | C42 | H16 | 179.0° | 180.0° |
| C05 | C06 | N07 | C10 | 176.6° | 179.9° |
| C05 | C06 | N07 | N08 | 177.7° | 179.6° |
| C05 | C06 | C10 | C11 | 4.9° | 0.1° |
| C05 | C06 | C10 | C09 | 177.6° | 179.7° |
| C06 | C05 | C41 | H15 | 1.9° | 0.1° |
| N07 | C06 | C10 | C11 | 178.6° | 180.0° |
| N07 | C06 | C10 | C09 | 1.2° | 0.4° |
| C06 | N07 | N08 | C09 | 0.6° | 0.3° |
| C06 | N07 | N08 | H17 | 179.4° | 180.0° |
| C10 | C06 | N07 | N08 | 1.1° | 0.4° |
| C06 | C10 | C11 | C09 | 177.4° | 179.6° |
| C06 | C10 | C11 | C12 | 68.4° | 60.4° |
| C06 | C10 | C11 | N33 | 179.5° | 179.6° |
| C06 | C10 | C09 | N08 | 0.8° | 0.2° |
| C06 | C10 | C09 | C39 | 179.3° | 179.8° |
| C06 | C10 | C11 | H1 | 55.6° | 61.1° |
| N07 | N08 | C09 | C10 | 0.1° | 0.1° |
| N07 | N08 | C09 | H17 | 180.0° | 179.7° |
| N07 | N08 | C09 | C39 | 179.9° | 180.0° |
| F29 | C26 | F27 | F28 | 121.4° | 120.0° |
| F29 | C26 | F27 | C25 | 120.0° | 120.0° |
| F29 | C26 | F28 | C25 | 118.6° | 120.0° |
| F29 | C26 | C25 | C30 | 123.9° | 120.0° |
| F29 | C26 | C25 | C24 | 56.4° | 59.5° |
| F37 | C35 | F36 | C38 | 120.6° | 120.0° |
| F37 | C35 | F36 | C34 | 120.5° | 120.0° |
| F37 | C35 | C38 | C34 | 120.8° | 120.1° |
| F37 | C35 | C34 | N33 | 25.5° | 60.0° |
| F37 | C35 | C34 | H5 | 145.8° | 180.0° |
| F37 | C35 | C34 | H6 | 94.9° | 60.0° |
| F37 | C35 | C38 | H7 | 180.0° | 180.0° |
| F37 | C35 | C38 | H8 | 60.0° | 59.9° |
| F37 | C35 | C38 | H9 | 60.0° | 60.0° |
| F27 | C26 | F28 | C25 | 119.2° | 120.0° |
| F27 | C26 | C25 | C30 | 2.3° | 120.0° |
| F27 | C26 | C25 | C24 | 178.0° | 60.5° |
| C10 | C11 | C12 | N33 | 114.2° | 116.7° |
| C10 | C11 | C12 | H1 | 123.8° | 121.6° |
| C10 | C11 | N33 | H1 | 123.8° | 119.2° |
| C11 | C10 | C09 | N08 | 179.3° | 180.0° |
| C11 | C10 | C09 | C39 | 0.9° | 0.0° |
| C10 | C11 | C12 | C13 | 127.6° | 107.9° |
| C10 | C11 | C12 | C32 | 54.2° | 72.4° |
| C10 | C11 | N33 | C39 | 2.5° | 0.0° |
| C10 | C11 | N33 | C34 | 179.1° | 179.9° |
| C09 | C10 | C11 | C12 | 109.1° | 119.2° |
| C09 | C10 | C11 | N33 | 2.1° | 0.0° |
| C10 | C09 | N08 | C39 | 179.8° | 180.0° |
| C10 | C09 | C39 | N33 | 0.7° | 0.0° |
| C10 | C09 | C39 | O40 | 179.9° | 180.0° |
| C09 | C10 | C11 | H1 | 127.0° | 119.2° |
| C10 | C09 | N08 | H17 | 179.8° | 179.7° |
| C12 | C11 | N33 | H1 | 121.0° | 121.6° |
| C11 | C12 | C13 | C32 | 178.2° | 179.8° |
| C11 | C12 | C13 | C14 | 178.8° | 180.0° |
| C12 | C11 | N33 | C39 | 112.7° | 119.2° |
| C12 | C11 | N33 | C34 | 63.9° | 60.9° |
| C11 | C12 | C32 | C31 | 179.0° | 179.7° |
| C11 | C12 | C13 | H2 | 1.2° | 0.1° |
| C11 | C12 | C32 | H14 | 1.0° | 0.0° |
| C11 | N33 | C39 | C09 | 2.0° | 0.0° |
| N33 | C11 | C12 | C13 | 118.2° | 135.4° |
| C11 | N33 | C34 | C35 | 60.8° | 90.0° |
| N33 | C11 | C12 | C32 | 60.0° | 44.3° |
| C11 | N33 | C39 | C34 | 176.6° | 179.9° |
| C11 | N33 | C39 | O40 | 178.6° | 180.0° |
| C11 | N33 | C34 | H5 | 59.6° | 30.1° |
| C11 | N33 | C34 | H6 | 178.9° | 150.0° |
| N08 | C09 | C39 | N33 | 179.1° | 180.0° |
| N08 | C09 | C39 | O40 | 0.3° | 0.0° |
| F28 | C26 | C25 | C30 | 116.6° | 0.0° |
| F28 | C26 | C25 | C24 | 63.0° | 179.5° |
| C26 | C25 | C30 | C24 | 179.7° | 179.5° |
| C26 | C25 | C30 | C17 | 179.3° | 180.0° |
| C26 | C25 | C24 | C19 | 179.7° | 179.9° |
| C26 | C25 | C30 | H4 | 0.6° | 0.3° |
| C26 | C25 | C24 | H12 | 0.3° | 0.2° |
| F36 | C35 | C38 | C34 | 119.0° | 120.0° |
| F36 | C35 | C34 | N33 | 95.3° | 60.1° |
| F36 | C35 | C34 | H5 | 25.0° | 60.0° |
| F36 | C35 | C34 | H6 | 144.3° | 180.0° |
| F36 | C35 | C38 | H7 | 59.7° | 60.0° |
| F36 | C35 | C38 | H8 | 60.3° | 60.0° |
| F36 | C35 | C38 | H9 | 179.7° | 180.0° |
| C09 | C39 | N33 | O40 | 179.4° | 180.0° |
| C09 | C39 | N33 | C34 | 178.6° | 179.9° |
| C39 | C09 | N08 | H17 | 0.1° | 0.3° |
| C12 | C13 | C14 | H2 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 0.2° | 0.0° |
| C13 | C12 | C32 | C31 | 0.7° | 0.5° |
| C13 | C12 | C11 | H1 | 3.8° | 13.7° |
| C12 | C13 | C14 | H3 | 179.8° | 180.0° |
| C13 | C12 | C32 | H14 | 179.3° | 179.7° |
| C14 | C13 | C12 | C32 | 0.7° | 0.3° |
| C13 | C14 | C15 | H3 | 180.0° | 180.0° |
| C13 | C14 | C15 | C31 | 0.2° | 0.0° |
| C13 | C14 | C15 | O16 | 179.8° | 180.0° |
| C38 | C35 | C34 | N33 | 146.8° | 180.0° |
| C38 | C35 | C34 | H5 | 92.8° | 60.0° |
| C38 | C35 | C34 | H6 | 26.5° | 60.1° |
| C35 | C38 | H7 | H8 | 120.0° | 120.0° |
| C35 | C38 | H7 | H9 | 120.0° | 120.0° |
| C35 | C38 | H8 | H9 | 120.0° | 119.9° |
| C35 | C34 | N33 | C39 | 123.2° | 89.9° |
| C35 | C34 | N33 | H5 | 120.4° | 120.1° |
| C35 | C34 | N33 | H6 | 120.4° | 120.0° |
| C35 | C34 | H5 | H6 | 118.9° | 120.0° |
| C34 | C35 | C38 | H7 | 59.2° | 60.0° |
| C34 | C35 | C38 | H8 | 179.2° | 180.0° |
| C34 | C35 | C38 | H9 | 60.8° | 60.0° |
| C12 | C32 | C31 | H14 | 180.0° | 179.8° |
| C12 | C32 | C31 | C15 | 0.3° | 0.5° |
| C32 | C12 | C11 | H1 | 178.0° | 166.0° |
| C32 | C12 | C13 | H2 | 179.3° | 179.8° |
| C12 | C32 | C31 | H13 | 179.7° | 179.7° |
| C39 | N33 | C11 | H1 | 126.3° | 119.2° |
| C39 | N33 | C34 | H5 | 116.4° | 150.0° |
| C39 | N33 | C34 | H6 | 2.9° | 30.1° |
| C34 | N33 | C39 | O40 | 2.0° | 0.1° |
| C34 | N33 | C11 | H1 | 57.1° | 60.7° |
| N33 | C34 | H5 | H6 | 118.9° | 119.9° |
| C14 | C15 | C31 | C32 | 0.2° | 0.2° |
| C14 | C15 | C31 | O16 | 179.7° | 180.0° |
| C14 | C15 | O16 | C17 | 6.4° | 83.8° |
| C15 | C14 | C13 | H2 | 179.8° | 179.9° |
| C14 | C15 | C31 | H13 | 179.8° | 179.9° |
| C25 | C30 | C17 | H4 | 180.0° | 179.7° |
| C30 | C25 | C24 | C19 | 0.0° | 0.6° |
| C25 | C30 | C17 | O16 | 178.5° | 179.7° |
| C25 | C30 | C17 | C18 | 1.9° | 0.2° |
| C30 | C25 | C24 | H12 | 180.0° | 179.7° |
| C24 | C25 | C30 | C17 | 1.0° | 0.5° |
| C25 | C24 | C19 | H12 | 180.0° | 179.7° |
| C25 | C24 | C19 | C18 | 0.0° | 0.3° |
| C25 | C24 | C19 | C20 | 179.5° | 179.7° |
| C24 | C25 | C30 | H4 | 179.0° | 179.8° |
| C30 | C17 | O16 | C15 | 71.3° | 1.9° |
| C30 | C17 | O16 | C18 | 176.7° | 179.9° |
| C30 | C17 | C18 | C19 | 1.9° | 0.0° |
| C30 | C17 | C18 | H11 | 178.1° | 180.0° |
| C32 | C31 | C15 | H13 | 180.0° | 179.8° |
| C32 | C31 | C15 | O16 | 179.8° | 179.8° |
| C24 | C19 | C18 | C17 | 0.9° | 0.1° |
| C24 | C19 | C18 | C20 | 179.5° | 179.9° |
| C24 | C19 | C20 | F21 | 20.9° | 60.0° |
| C24 | C19 | C20 | F22 | 141.7° | 179.9° |
| C24 | C19 | C20 | F23 | 98.9° | 60.0° |
| C24 | C19 | C18 | H11 | 179.1° | 180.0° |
| C31 | C15 | O16 | C17 | 173.9° | 96.2° |
| C31 | C15 | C14 | H3 | 179.8° | 180.0° |
| C15 | C31 | C32 | H14 | 179.7° | 179.7° |
| C15 | O16 | C17 | C18 | 112.0° | 178.2° |
| O16 | C15 | C14 | H3 | 0.2° | 0.0° |
| O16 | C15 | C31 | H13 | 0.1° | 0.0° |
| O16 | C17 | C18 | C19 | 178.5° | 180.0° |
| O16 | C17 | C30 | H4 | 1.5° | 0.0° |
| O16 | C17 | C18 | H11 | 1.4° | 0.0° |
| C17 | C18 | C19 | H11 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 179.6° | 180.0° |
| C18 | C17 | C30 | H4 | 178.1° | 179.9° |
| C18 | C19 | C20 | F21 | 159.6° | 119.9° |
| C18 | C19 | C20 | F22 | 38.8° | 0.0° |
| C18 | C19 | C20 | F23 | 80.6° | 120.0° |
| C18 | C19 | C24 | H12 | 180.0° | 179.9° |
| C19 | C20 | F21 | F22 | 120.7° | 119.9° |
| C19 | C20 | F21 | F23 | 118.9° | 120.0° |
| C19 | C20 | F22 | F23 | 118.6° | 120.0° |
| C20 | C19 | C18 | H11 | 0.4° | 0.0° |
| C20 | C19 | C24 | H12 | 0.5° | 0.0° |
| F21 | C20 | F22 | F23 | 120.5° | 120.1° |
| H2 | C13 | C14 | H3 | 0.2° | 0.0° |
| H7 | C38 | H8 | H9 | 120.0° | 120.0° |
| H10 | C43 | C42 | H16 | 0.0° | 0.2° |
| H13 | C31 | C32 | H14 | 0.3° | 0.1° |
| H15 | C41 | C42 | H16 | 1.0° | 0.1° |
