9Y9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C4 | doub | 1.38Å | 1.41Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| F5 | C2 | sing | 1.35Å | 1.29Å | |
| C2 | C3 | doub | 1.38Å | 1.42Å | Aromatic |
| C3 | C6 | sing | 1.40Å | 1.42Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | C7 | sing | 1.38Å | 1.42Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | C6 | doub | 1.38Å | 1.43Å | Aromatic |
| C6 | C9 | sing | 1.51Å | 1.53Å | |
| C7 | S8 | sing | 1.76Å | 1.75Å | |
| O16 | S8 | doub | 1.42Å | 1.44Å | |
| S8 | N10 | sing | 1.66Å | 1.66Å | |
| S8 | O15 | doub | 1.42Å | 1.42Å | |
| C9 | C11 | sing | 1.52Å | 1.54Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C14 | N10 | sing | 1.46Å | 1.47Å | |
| N10 | C12 | sing | 1.44Å | 1.46Å | |
| C12 | C11 | sing | 1.54Å | 1.51Å | |
| C11 | C13 | sing | 1.53Å | 1.56Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C14 | C17 | sing | 1.53Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| O30 | C17 | sing | 1.43Å | 1.42Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | N19 | sing | 1.47Å | 1.50Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| N19 | C27 | sing | 1.35Å | 1.36Å | |
| N19 | HN19 | sing | 0.97Å | 1.00Å | |
| C21 | C20 | sing | 1.51Å | 1.47Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C26 | C21 | doub | 1.38Å | 1.42Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.42Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C24 | C23 | sing | 1.38Å | 1.42Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C25 | C24 | doub | 1.38Å | 1.40Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | C26 | sing | 1.38Å | 1.41Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | O29 | sing | 1.35Å | 1.36Å | |
| C27 | O28 | doub | 1.21Å | 1.25Å | |
| O29 | C31 | sing | 1.45Å | 1.46Å | |
| O30 | HO30 | sing | 0.97Å | 0.95Å | |
| C31 | C33 | sing | 1.53Å | 1.54Å | |
| C31 | C34 | sing | 1.53Å | 1.52Å | |
| C31 | C32 | sing | 1.53Å | 1.54Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C33 | H33B | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C34 | H34B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | C1 | C2 | 116.3° | 119.0° |
| C4 | C1 | H1 | 121.9° | 120.6° |
| C1 | C4 | C7 | 120.7° | 120.5° |
| C1 | C4 | H4 | 119.7° | 119.7° |
| C2 | C1 | H1 | 121.8° | 120.5° |
| C1 | C2 | F5 | 119.5° | 119.9° |
| C1 | C2 | C3 | 124.0° | 120.1° |
| F5 | C2 | C3 | 116.4° | 119.9° |
| C2 | C3 | C6 | 120.6° | 121.3° |
| C2 | C3 | H3 | 119.7° | 119.3° |
| C6 | C3 | H3 | 119.7° | 119.3° |
| C3 | C6 | C7 | 114.8° | 117.6° |
| C3 | C6 | C9 | 119.3° | 114.6° |
| C7 | C4 | H4 | 119.6° | 119.8° |
| C4 | C7 | C6 | 123.5° | 121.3° |
| C4 | C7 | S8 | 116.9° | 118.8° |
| C7 | C6 | C9 | 125.9° | 127.7° |
| C6 | C7 | S8 | 119.6° | 119.9° |
| C6 | C9 | C11 | 116.7° | 113.9° |
| C6 | C9 | H9 | 107.1° | 108.7° |
| C6 | C9 | H9A | 107.1° | 108.6° |
| C7 | S8 | O16 | 110.9° | 106.6° |
| C7 | S8 | N10 | 104.2° | 105.8° |
| C7 | S8 | O15 | 104.9° | 106.6° |
| O16 | S8 | N10 | 106.5° | 106.6° |
| O16 | S8 | O15 | 121.5° | 123.4° |
| N10 | S8 | O15 | 107.6° | 106.6° |
| S8 | N10 | C14 | 119.5° | 121.3° |
| S8 | N10 | C12 | 121.0° | 117.5° |
| C11 | C9 | H9 | 107.1° | 108.6° |
| C11 | C9 | H9A | 107.1° | 108.6° |
| C9 | C11 | C12 | 114.9° | 110.2° |
| C9 | C11 | C13 | 112.5° | 109.4° |
| C9 | C11 | H11 | 101.9° | 109.3° |
| H9 | C9 | H9A | 111.7° | 108.4° |
| C14 | N10 | C12 | 117.3° | 121.2° |
| N10 | C14 | C17 | 109.7° | 109.5° |
| N10 | C14 | H14 | 109.4° | 109.5° |
| N10 | C14 | H14A | 109.4° | 109.4° |
| N10 | C12 | C11 | 112.3° | 109.0° |
| N10 | C12 | H12 | 108.6° | 109.5° |
| N10 | C12 | H12A | 108.6° | 109.6° |
| C12 | C11 | C13 | 104.2° | 109.3° |
| C12 | C11 | H11 | 110.5° | 109.2° |
| C11 | C12 | H12 | 108.5° | 109.6° |
| C11 | C12 | H12A | 108.5° | 109.5° |
| C13 | C11 | H11 | 113.1° | 109.3° |
| C11 | C13 | H13 | 109.5° | 109.5° |
| C11 | C13 | H13A | 109.5° | 109.5° |
| C11 | C13 | H13B | 109.5° | 109.5° |
| H12 | C12 | H12A | 110.4° | 109.6° |
| H13 | C13 | H13A | 109.4° | 109.5° |
| H13 | C13 | H13B | 109.5° | 109.4° |
| H13A | C13 | H13B | 109.4° | 109.5° |
| C17 | C14 | H14 | 109.4° | 109.4° |
| C17 | C14 | H14A | 109.4° | 109.5° |
| C14 | C17 | O30 | 111.0° | 109.5° |
| C14 | C17 | C18 | 120.5° | 109.5° |
| C14 | C17 | H17 | 99.8° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.4° |
| O30 | C17 | C18 | 108.9° | 109.4° |
| O30 | C17 | H17 | 113.7° | 109.5° |
| C17 | O30 | HO30 | 109.5° | 114.0° |
| C18 | C17 | H17 | 102.3° | 109.4° |
| C17 | C18 | C20 | 115.1° | 109.4° |
| C17 | C18 | N19 | 109.4° | 109.5° |
| C17 | C18 | H18 | 106.7° | 109.4° |
| C20 | C18 | N19 | 112.8° | 109.5° |
| C20 | C18 | H18 | 102.8° | 109.5° |
| C18 | C20 | C21 | 109.6° | 109.4° |
| C18 | C20 | H20 | 109.4° | 109.5° |
| C18 | C20 | H20A | 109.4° | 109.5° |
| N19 | C18 | H18 | 109.4° | 109.5° |
| C18 | N19 | C27 | 121.2° | 120.0° |
| C18 | N19 | HN19 | 119.3° | 120.0° |
| C27 | N19 | HN19 | 119.4° | 120.0° |
| N19 | C27 | O29 | 109.3° | 120.0° |
| N19 | C27 | O28 | 124.1° | 120.0° |
| C21 | C20 | H20 | 109.4° | 109.4° |
| C21 | C20 | H20A | 109.4° | 109.5° |
| C20 | C21 | C26 | 118.8° | 120.0° |
| C20 | C21 | C22 | 119.4° | 120.0° |
| H20 | C20 | H20A | 109.5° | 109.5° |
| C26 | C21 | C22 | 121.8° | 120.0° |
| C21 | C26 | C25 | 118.7° | 120.0° |
| C21 | C26 | H26 | 120.7° | 120.0° |
| C21 | C22 | C23 | 118.5° | 120.0° |
| C21 | C22 | H22 | 120.8° | 120.0° |
| C23 | C22 | H22 | 120.7° | 120.1° |
| C22 | C23 | C24 | 120.4° | 120.0° |
| C22 | C23 | H23 | 119.8° | 119.9° |
| C24 | C23 | H23 | 119.8° | 120.1° |
| C23 | C24 | C25 | 120.5° | 120.0° |
| C23 | C24 | H24 | 119.8° | 120.0° |
| C25 | C24 | H24 | 119.7° | 120.0° |
| C24 | C25 | C26 | 120.2° | 120.0° |
| C24 | C25 | H25 | 119.9° | 120.0° |
| C26 | C25 | H25 | 119.9° | 120.0° |
| C25 | C26 | H26 | 120.6° | 120.0° |
| O29 | C27 | O28 | 126.6° | 120.0° |
| C27 | O29 | C31 | 121.9° | 117.0° |
| O29 | C31 | C33 | 104.6° | 109.5° |
| O29 | C31 | C34 | 111.3° | 109.5° |
| O29 | C31 | C32 | 110.1° | 109.5° |
| C33 | C31 | C34 | 108.6° | 109.5° |
| C33 | C31 | C32 | 109.2° | 109.5° |
| C31 | C33 | H33 | 109.5° | 109.5° |
| C31 | C33 | H33A | 109.5° | 109.5° |
| C31 | C33 | H33B | 109.5° | 109.5° |
| C34 | C31 | C32 | 112.7° | 109.5° |
| C31 | C34 | H34 | 109.5° | 109.4° |
| C31 | C34 | H34A | 109.5° | 109.5° |
| C31 | C34 | H34B | 109.5° | 109.4° |
| C31 | C32 | H32 | 109.5° | 109.5° |
| C31 | C32 | H32A | 109.4° | 109.4° |
| C31 | C32 | H32B | 109.5° | 109.4° |
| H32 | C32 | H32A | 109.4° | 109.5° |
| H32 | C32 | H32B | 109.5° | 109.5° |
| H32A | C32 | H32B | 109.5° | 109.5° |
| H33 | C33 | H33A | 109.5° | 109.5° |
| H33 | C33 | H33B | 109.5° | 109.5° |
| H33A | C33 | H33B | 109.5° | 109.4° |
| H34 | C34 | H34A | 109.5° | 109.5° |
| H34 | C34 | H34B | 109.5° | 109.5° |
| H34A | C34 | H34B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | C1 | C2 | H1 | 180.0° | 179.8° |
| C4 | C1 | C2 | F5 | 179.5° | 178.3° |
| C4 | C1 | C2 | C3 | 1.0° | 1.7° |
| C1 | C4 | C7 | H4 | 180.0° | 180.0° |
| C1 | C4 | C7 | C6 | 0.7° | 3.6° |
| C1 | C4 | C7 | S8 | 179.7° | 173.5° |
| C1 | C2 | F5 | C3 | 178.6° | 180.0° |
| C1 | C2 | C3 | C6 | 0.6° | 1.1° |
| C1 | C2 | C3 | H3 | 179.4° | 178.8° |
| C2 | C1 | C4 | C7 | 0.4° | 0.6° |
| C2 | C1 | C4 | H4 | 179.6° | 179.4° |
| H1 | C1 | C2 | F5 | 0.5° | 1.5° |
| H1 | C1 | C2 | C3 | 179.0° | 178.5° |
| H1 | C1 | C4 | C7 | 179.6° | 179.2° |
| H1 | C1 | C4 | H4 | 0.4° | 0.8° |
| F5 | C2 | C3 | C6 | 179.1° | 178.9° |
| F5 | C2 | C3 | H3 | 0.9° | 1.2° |
| C2 | C3 | C6 | H3 | 180.0° | 179.9° |
| C2 | C3 | C6 | C7 | 0.4° | 1.8° |
| C2 | C3 | C6 | C9 | 179.1° | 176.1° |
| C3 | C6 | C7 | C4 | 1.1° | 4.1° |
| C3 | C6 | C7 | C9 | 178.5° | 177.6° |
| C3 | C6 | C7 | S8 | 179.4° | 172.9° |
| C3 | C6 | C9 | C11 | 116.9° | 149.6° |
| C3 | C6 | C9 | H9 | 123.1° | 89.2° |
| C3 | C6 | C9 | H9A | 3.1° | 28.5° |
| H3 | C3 | C6 | C7 | 179.5° | 178.3° |
| H3 | C3 | C6 | C9 | 0.9° | 3.8° |
| C4 | C7 | C6 | S8 | 179.6° | 177.0° |
| C4 | C7 | C6 | C9 | 179.6° | 173.5° |
| C4 | C7 | S8 | O16 | 11.6° | 110.3° |
| C4 | C7 | S8 | N10 | 125.7° | 136.5° |
| C4 | C7 | S8 | O15 | 121.4° | 23.2° |
| H4 | C4 | C7 | C6 | 179.3° | 176.4° |
| H4 | C4 | C7 | S8 | 0.3° | 6.5° |
| C6 | C7 | S8 | O16 | 168.9° | 66.8° |
| C6 | C7 | S8 | N10 | 54.7° | 46.5° |
| C6 | C7 | S8 | O15 | 58.2° | 159.7° |
| C7 | C6 | C9 | C11 | 61.6° | 32.7° |
| C7 | C6 | C9 | H9 | 58.4° | 88.5° |
| C7 | C6 | C9 | H9A | 178.4° | 153.8° |
| C9 | C6 | C7 | S8 | 0.8° | 9.5° |
| C6 | C9 | C11 | H9 | 120.0° | 121.2° |
| C6 | C9 | C11 | H9A | 120.0° | 121.2° |
| C6 | C9 | H9 | H9A | 117.0° | 117.9° |
| C6 | C9 | C11 | C12 | 78.1° | 92.1° |
| C6 | C9 | C11 | C13 | 162.9° | 147.6° |
| C6 | C9 | C11 | H11 | 41.5° | 27.9° |
| C7 | S8 | O16 | N10 | 112.7° | 112.7° |
| C7 | S8 | O16 | O15 | 123.9° | 123.7° |
| C7 | S8 | N10 | O15 | 111.0° | 113.2° |
| C7 | S8 | N10 | C14 | 80.8° | 93.3° |
| C7 | S8 | N10 | C12 | 82.3° | 86.7° |
| O16 | S8 | N10 | O15 | 131.7° | 133.5° |
| O16 | S8 | N10 | C14 | 36.5° | 153.5° |
| O16 | S8 | N10 | C12 | 160.4° | 26.6° |
| S8 | N10 | C14 | C12 | 163.7° | 179.9° |
| S8 | N10 | C12 | C11 | 75.9° | 32.1° |
| S8 | N10 | C12 | H12 | 164.1° | 87.8° |
| S8 | N10 | C12 | H12A | 44.1° | 151.9° |
| S8 | N10 | C14 | C17 | 114.1° | 95.0° |
| S8 | N10 | C14 | H14 | 125.9° | 145.0° |
| S8 | N10 | C14 | H14A | 5.9° | 25.0° |
| O15 | S8 | N10 | C14 | 168.2° | 20.0° |
| O15 | S8 | N10 | C12 | 28.7° | 160.1° |
| C11 | C9 | H9 | H9A | 117.0° | 117.8° |
| C9 | C11 | C12 | N10 | 65.6° | 63.6° |
| C9 | C11 | C12 | C13 | 123.5° | 120.3° |
| C9 | C11 | C12 | H11 | 114.7° | 120.1° |
| C9 | C11 | C13 | H11 | 114.8° | 119.7° |
| C9 | C11 | C12 | H12 | 174.4° | 176.5° |
| C9 | C11 | C12 | H12A | 54.5° | 56.2° |
| C9 | C11 | C13 | H13 | 180.0° | 59.9° |
| C9 | C11 | C13 | H13A | 60.0° | 180.0° |
| C9 | C11 | C13 | H13B | 60.0° | 60.0° |
| H9 | C9 | C11 | C12 | 41.9° | 29.1° |
| H9 | C9 | C11 | C13 | 77.1° | 91.2° |
| H9 | C9 | C11 | H11 | 161.4° | 149.1° |
| H9A | C9 | C11 | C12 | 161.9° | 146.7° |
| H9A | C9 | C11 | C13 | 42.9° | 26.4° |
| H9A | C9 | C11 | H11 | 78.5° | 93.3° |
| C14 | N10 | C12 | C11 | 87.5° | 147.8° |
| C14 | N10 | C12 | H12 | 32.5° | 92.3° |
| C14 | N10 | C12 | H12A | 152.5° | 28.0° |
| N10 | C14 | C17 | H14 | 120.0° | 120.1° |
| N10 | C14 | C17 | H14A | 120.0° | 120.0° |
| N10 | C14 | H14 | H14A | 119.9° | 120.0° |
| N10 | C14 | C17 | O30 | 166.2° | 65.0° |
| N10 | C14 | C17 | C18 | 64.8° | 175.0° |
| N10 | C14 | C17 | H17 | 45.9° | 55.0° |
| N10 | C12 | C11 | H12 | 120.0° | 119.8° |
| N10 | C12 | C11 | H12A | 120.0° | 119.9° |
| N10 | C12 | C11 | C13 | 170.9° | 176.1° |
| N10 | C12 | C11 | H11 | 49.1° | 56.5° |
| N10 | C12 | H12 | H12A | 118.9° | 120.2° |
| C12 | N10 | C14 | C17 | 82.3° | 85.0° |
| C12 | N10 | C14 | H14 | 37.7° | 35.0° |
| C12 | N10 | C14 | H14A | 157.7° | 155.0° |
| C12 | C11 | C13 | H11 | 120.1° | 119.5° |
| C11 | C12 | H12 | H12A | 118.8° | 120.2° |
| C12 | C11 | C13 | H13 | 54.9° | 179.3° |
| C12 | C11 | C13 | H13A | 65.1° | 59.2° |
| C12 | C11 | C13 | H13B | 174.9° | 60.8° |
| C13 | C11 | C12 | H12 | 50.9° | 56.2° |
| C13 | C11 | C12 | H12A | 69.1° | 64.0° |
| C11 | C13 | H13 | H13A | 120.0° | 120.1° |
| C11 | C13 | H13 | H13B | 120.0° | 119.9° |
| C11 | C13 | H13A | H13B | 120.0° | 120.0° |
| H11 | C11 | C12 | H12 | 70.9° | 63.3° |
| H11 | C11 | C12 | H12A | 169.1° | 176.4° |
| H11 | C11 | C13 | H13 | 65.2° | 59.8° |
| H11 | C11 | C13 | H13A | 174.8° | 60.3° |
| H11 | C11 | C13 | H13B | 54.8° | 179.7° |
| H13 | C13 | H13A | H13B | 120.0° | 120.0° |
| C17 | C14 | H14 | H14A | 119.9° | 120.0° |
| C14 | C17 | O30 | C18 | 134.9° | 120.0° |
| C14 | C17 | O30 | H17 | 111.6° | 120.0° |
| C14 | C17 | C18 | H17 | 109.3° | 120.0° |
| C14 | C17 | C18 | C20 | 68.2° | 65.0° |
| C14 | C17 | C18 | N19 | 163.5° | 175.0° |
| C14 | C17 | C18 | H18 | 45.2° | 55.0° |
| C14 | C17 | O30 | HO30 | 180.0° | 59.9° |
| H14 | C14 | C17 | O30 | 46.2° | 55.0° |
| H14 | C14 | C17 | C18 | 175.2° | 64.9° |
| H14 | C14 | C17 | H17 | 74.1° | 175.1° |
| H14A | C14 | C17 | O30 | 73.8° | 175.0° |
| H14A | C14 | C17 | C18 | 55.3° | 55.0° |
| H14A | C14 | C17 | H17 | 166.0° | 65.0° |
| O30 | C17 | C18 | H17 | 120.7° | 120.0° |
| O30 | C17 | C18 | C20 | 61.7° | 55.0° |
| O30 | C17 | C18 | N19 | 66.5° | 65.0° |
| O30 | C17 | C18 | H18 | 175.2° | 175.0° |
| C17 | C18 | C20 | N19 | 126.6° | 120.0° |
| C17 | C18 | C20 | H18 | 115.7° | 120.0° |
| C17 | C18 | N19 | H18 | 116.6° | 120.0° |
| C17 | C18 | N19 | C27 | 92.2° | 155.0° |
| C17 | C18 | N19 | HN19 | 87.8° | 25.0° |
| C17 | C18 | C20 | C21 | 176.9° | 175.0° |
| C17 | C18 | C20 | H20 | 63.1° | 65.1° |
| C17 | C18 | C20 | H20A | 57.0° | 55.0° |
| C18 | C17 | O30 | HO30 | 45.0° | 60.1° |
| H17 | C17 | C18 | C20 | 177.6° | 175.0° |
| H17 | C17 | C18 | N19 | 54.2° | 55.0° |
| H17 | C17 | C18 | H18 | 64.1° | 65.0° |
| H17 | C17 | O30 | HO30 | 68.4° | 179.9° |
| C20 | C18 | N19 | H18 | 113.8° | 120.1° |
| C20 | C18 | N19 | C27 | 138.2° | 85.1° |
| C20 | C18 | N19 | HN19 | 41.8° | 95.0° |
| C18 | C20 | C21 | H20 | 120.0° | 120.0° |
| C18 | C20 | C21 | H20A | 120.0° | 120.0° |
| C18 | C20 | H20 | H20A | 119.9° | 120.0° |
| C18 | C20 | C21 | C26 | 99.2° | 90.3° |
| C18 | C20 | C21 | C22 | 79.6° | 90.0° |
| C18 | N19 | C27 | HN19 | 180.0° | 179.9° |
| N19 | C18 | C20 | C21 | 56.5° | 65.0° |
| N19 | C18 | C20 | H20 | 63.5° | 54.9° |
| N19 | C18 | C20 | H20A | 176.5° | 175.0° |
| C18 | N19 | C27 | O29 | 179.8° | 180.0° |
| C18 | N19 | C27 | O28 | 1.1° | 0.0° |
| H18 | C18 | N19 | C27 | 24.4° | 35.0° |
| H18 | C18 | N19 | HN19 | 155.6° | 145.0° |
| H18 | C18 | C20 | C21 | 61.3° | 55.0° |
| H18 | C18 | C20 | H20 | 178.7° | 175.0° |
| H18 | C18 | C20 | H20A | 58.7° | 65.0° |
| N19 | C27 | O29 | O28 | 179.0° | 179.9° |
| N19 | C27 | O29 | C31 | 171.8° | 180.0° |
| HN19 | N19 | C27 | O29 | 0.2° | 0.1° |
| HN19 | N19 | C27 | O28 | 178.9° | 180.0° |
| C21 | C20 | H20 | H20A | 119.9° | 120.1° |
| C20 | C21 | C26 | C22 | 178.8° | 179.7° |
| C20 | C21 | C22 | C23 | 179.2° | 180.0° |
| C20 | C21 | C22 | H22 | 0.8° | 0.1° |
| C20 | C21 | C26 | C25 | 178.7° | 179.7° |
| C20 | C21 | C26 | H26 | 1.2° | 0.3° |
| H20 | C20 | C21 | C26 | 20.8° | 149.7° |
| H20 | C20 | C21 | C22 | 160.4° | 29.9° |
| H20A | C20 | C21 | C26 | 140.8° | 29.7° |
| H20A | C20 | C21 | C22 | 40.4° | 150.0° |
| C26 | C21 | C22 | C23 | 0.4° | 0.3° |
| C26 | C21 | C22 | H22 | 179.6° | 179.7° |
| C21 | C26 | C25 | C24 | 0.0° | 0.6° |
| C21 | C26 | C25 | H26 | 180.0° | 179.4° |
| C21 | C26 | C25 | H25 | 180.0° | 179.7° |
| C21 | C22 | C23 | H22 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 1.1° | 0.0° |
| C21 | C22 | C23 | H23 | 178.9° | 179.9° |
| C22 | C21 | C26 | C25 | 0.1° | 0.6° |
| C22 | C21 | C26 | H26 | 179.9° | 180.0° |
| C22 | C23 | C24 | H23 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 1.2° | 0.0° |
| C22 | C23 | C24 | H24 | 178.8° | 180.0° |
| H22 | C22 | C23 | C24 | 179.0° | 179.9° |
| H22 | C22 | C23 | H23 | 1.0° | 0.0° |
| C23 | C24 | C25 | H24 | 180.0° | 180.0° |
| C23 | C24 | C25 | C26 | 0.7° | 0.3° |
| C23 | C24 | C25 | H25 | 179.3° | 180.0° |
| H23 | C23 | C24 | C25 | 178.8° | 179.9° |
| H23 | C23 | C24 | H24 | 1.2° | 0.0° |
| C24 | C25 | C26 | H25 | 180.0° | 179.7° |
| C24 | C25 | C26 | H26 | 180.0° | 180.0° |
| H24 | C24 | C25 | C26 | 179.3° | 179.7° |
| H24 | C24 | C25 | H25 | 0.7° | 0.0° |
| H25 | C25 | C26 | H26 | 0.1° | 0.3° |
| C27 | O29 | C31 | C33 | 179.7° | 60.0° |
| C27 | O29 | C31 | C34 | 63.2° | 180.0° |
| C27 | O29 | C31 | C32 | 62.5° | 60.0° |
| O28 | C27 | O29 | C31 | 7.2° | 0.0° |
| O29 | C31 | C33 | C34 | 118.9° | 120.0° |
| O29 | C31 | C33 | C32 | 117.8° | 120.0° |
| O29 | C31 | C34 | C32 | 124.2° | 120.0° |
| O29 | C31 | C32 | H32 | 180.0° | 60.0° |
| O29 | C31 | C32 | H32A | 60.0° | 180.0° |
| O29 | C31 | C32 | H32B | 60.0° | 60.0° |
| O29 | C31 | C33 | H33 | 180.0° | 60.0° |
| O29 | C31 | C33 | H33A | 60.0° | 179.9° |
| O29 | C31 | C33 | H33B | 60.0° | 60.0° |
| O29 | C31 | C34 | H34 | 180.0° | 60.0° |
| O29 | C31 | C34 | H34A | 60.0° | 179.9° |
| O29 | C31 | C34 | H34B | 60.0° | 60.0° |
| C33 | C31 | C34 | C32 | 121.2° | 120.0° |
| C33 | C31 | C32 | H32 | 65.7° | 60.0° |
| C33 | C31 | C32 | H32A | 174.3° | 60.0° |
| C33 | C31 | C32 | H32B | 54.3° | 180.0° |
| C31 | C33 | H33 | H33A | 120.0° | 120.0° |
| C31 | C33 | H33 | H33B | 120.0° | 120.0° |
| C31 | C33 | H33A | H33B | 120.0° | 119.9° |
| C33 | C31 | C34 | H34 | 65.4° | 180.0° |
| C33 | C31 | C34 | H34A | 54.6° | 60.0° |
| C33 | C31 | C34 | H34B | 174.6° | 60.0° |
| C34 | C31 | C32 | H32 | 55.1° | 180.0° |
| C34 | C31 | C32 | H32A | 64.8° | 60.0° |
| C34 | C31 | C32 | H32B | 175.1° | 60.0° |
| C34 | C31 | C33 | H33 | 61.1° | 60.0° |
| C34 | C31 | C33 | H33A | 178.9° | 60.0° |
| C34 | C31 | C33 | H33B | 58.9° | 180.0° |
| C31 | C34 | H34 | H34A | 120.0° | 120.0° |
| C31 | C34 | H34 | H34B | 120.0° | 119.9° |
| C31 | C34 | H34A | H34B | 120.0° | 120.0° |
| C31 | C32 | H32 | H32A | 120.0° | 120.0° |
| C31 | C32 | H32 | H32B | 120.0° | 120.0° |
| C31 | C32 | H32A | H32B | 120.0° | 120.0° |
| C32 | C31 | C33 | H33 | 62.2° | 180.0° |
| C32 | C31 | C33 | H33A | 57.8° | 59.9° |
| C32 | C31 | C33 | H33B | 177.8° | 60.0° |
| C32 | C31 | C34 | H34 | 55.8° | 60.0° |
| C32 | C31 | C34 | H34A | 175.8° | 60.0° |
| C32 | C31 | C34 | H34B | 64.2° | 180.0° |
| H32 | C32 | H32A | H32B | 120.0° | 120.0° |
| H33 | C33 | H33A | H33B | 120.0° | 120.0° |
| H34 | C34 | H34A | H34B | 120.0° | 120.1° |
