YJ9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C1 | N10 | sing | 1.47Å | 1.44Å | |
| C1 | C13 | sing | 1.54Å | 1.53Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | N3 | sing | 1.35Å | 1.37Å | |
| C2 | O6 | doub | 1.21Å | 1.25Å | |
| N3 | C4 | sing | 1.47Å | 1.41Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å | |
| C4 | C5 | sing | 1.51Å | 1.47Å | |
| C4 | C7 | sing | 1.53Å | 1.52Å | |
| C4 | C8 | sing | 1.53Å | 1.52Å | |
| C5 | N9 | doub | 1.28Å | 1.30Å | |
| C7 | C8 | sing | 1.53Å | 1.50Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| N10 | C11 | sing | 1.47Å | 1.45Å | |
| N10 | C24 | sing | 1.35Å | 1.37Å | |
| C11 | C12 | sing | 1.55Å | 1.55Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.55Å | 1.52Å | |
| C12 | S14 | sing | 1.81Å | 1.73Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| S14 | C15 | sing | 1.76Å | 1.71Å | |
| S14 | O22 | doub | 1.42Å | 1.42Å | |
| S14 | O23 | doub | 1.42Å | 1.41Å | |
| C15 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C20 | sing | 1.38Å | 1.43Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | CL | sing | 1.74Å | 1.67Å | |
| C17 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C24 | O25 | doub | 1.21Å | 1.26Å | |
| C24 | C27 | sing | 1.51Å | 1.50Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C26 | C28 | sing | 1.53Å | 1.50Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C27 | C28 | sing | 1.53Å | 1.50Å | |
| C27 | C33 | sing | 1.51Å | 1.49Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | C30 | doub | 1.38Å | 1.40Å | Aromatic |
| C29 | C34 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | C31 | sing | 1.38Å | 1.38Å | Aromatic |
| C30 | C35 | sing | 1.51Å | 1.52Å | |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C33 | C34 | doub | 1.38Å | 1.41Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | F36 | sing | 1.40Å | 1.33Å | |
| C35 | F37 | sing | 1.40Å | 1.34Å | |
| C35 | F38 | sing | 1.40Å | 1.34Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| N9 | H9 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N10 | 114.7° | 109.9° |
| C2 | C1 | C13 | 108.2° | 109.9° |
| C2 | C1 | H1 | 105.6° | 109.9° |
| C1 | C2 | N3 | 114.5° | 120.0° |
| C1 | C2 | O6 | 120.9° | 120.0° |
| N10 | C1 | C13 | 105.4° | 107.3° |
| N10 | C1 | H1 | 108.4° | 109.9° |
| C1 | N10 | C11 | 111.0° | 108.7° |
| C1 | N10 | C24 | 119.5° | 125.6° |
| C13 | C1 | H1 | 114.8° | 110.0° |
| C1 | C13 | C12 | 103.4° | 102.9° |
| C1 | C13 | H13 | 111.6° | 110.7° |
| C1 | C13 | H13A | 111.5° | 110.7° |
| N3 | C2 | O6 | 124.5° | 120.0° |
| C2 | N3 | C4 | 124.3° | 120.0° |
| C2 | N3 | HN3 | 117.9° | 120.0° |
| C4 | N3 | HN3 | 117.8° | 120.0° |
| N3 | C4 | C5 | 111.2° | 115.5° |
| N3 | C4 | C7 | 122.2° | 117.5° |
| N3 | C4 | C8 | 119.7° | 117.5° |
| C5 | C4 | C7 | 117.3° | 117.5° |
| C5 | C4 | C8 | 118.5° | 117.5° |
| C4 | C5 | N9 | 127.5° | 120.0° |
| C4 | C5 | H5 | 116.2° | 120.0° |
| C7 | C4 | C8 | 59.0° | 60.1° |
| C4 | C7 | C8 | 60.5° | 60.0° |
| C4 | C7 | H7 | 130.6° | 117.5° |
| C4 | C7 | H7A | 130.6° | 117.5° |
| C4 | C8 | C7 | 60.5° | 60.0° |
| C4 | C8 | H8 | 130.6° | 117.5° |
| C4 | C8 | H8A | 130.6° | 117.6° |
| N9 | C5 | H5 | 116.2° | 120.0° |
| C5 | N9 | H9 | 112.0° | 120.0° |
| C8 | C7 | H7 | 130.6° | 117.5° |
| C8 | C7 | H7A | 130.6° | 117.5° |
| C7 | C8 | H8 | 130.6° | 117.5° |
| C7 | C8 | H8A | 130.6° | 117.5° |
| H7 | C7 | H7A | 82.2° | 115.6° |
| H8 | C8 | H8A | 82.2° | 115.5° |
| C11 | N10 | C24 | 127.7° | 125.7° |
| N10 | C11 | C12 | 104.8° | 104.8° |
| N10 | C11 | H11 | 111.1° | 110.5° |
| N10 | C11 | H11A | 111.0° | 110.4° |
| N10 | C24 | O25 | 118.1° | 120.0° |
| N10 | C24 | C27 | 118.1° | 120.0° |
| C12 | C11 | H11 | 111.1° | 110.3° |
| C12 | C11 | H11A | 111.1° | 110.3° |
| C11 | C12 | C13 | 101.9° | 101.6° |
| C11 | C12 | S14 | 115.8° | 111.1° |
| C11 | C12 | H12 | 110.8° | 111.0° |
| H11 | C11 | H11A | 107.8° | 110.4° |
| C13 | C12 | S14 | 110.4° | 111.0° |
| C13 | C12 | H12 | 116.1° | 111.0° |
| C12 | C13 | H13 | 111.5° | 110.7° |
| C12 | C13 | H13A | 111.5° | 110.7° |
| S14 | C12 | H12 | 102.3° | 110.9° |
| C12 | S14 | C15 | 103.8° | 104.5° |
| C12 | S14 | O22 | 106.4° | 110.6° |
| C12 | S14 | O23 | 108.1° | 110.5° |
| H13 | C13 | H13A | 107.3° | 110.8° |
| C15 | S14 | O22 | 111.4° | 104.3° |
| C15 | S14 | O23 | 107.9° | 104.2° |
| S14 | C15 | C16 | 126.1° | 120.0° |
| S14 | C15 | C20 | 120.5° | 120.0° |
| O22 | S14 | O23 | 118.3° | 121.0° |
| C16 | C15 | C20 | 113.4° | 120.0° |
| C15 | C16 | C17 | 124.7° | 120.0° |
| C15 | C16 | CL | 120.2° | 120.0° |
| C15 | C20 | C19 | 122.6° | 120.0° |
| C15 | C20 | H20 | 118.7° | 120.0° |
| C17 | C16 | CL | 115.1° | 120.0° |
| C16 | C17 | C18 | 119.4° | 120.0° |
| C16 | C17 | H17 | 120.3° | 120.1° |
| C18 | C17 | H17 | 120.3° | 120.0° |
| C17 | C18 | C19 | 118.6° | 120.0° |
| C17 | C18 | H18 | 120.7° | 120.0° |
| C19 | C18 | H18 | 120.7° | 120.0° |
| C18 | C19 | C20 | 121.3° | 120.0° |
| C18 | C19 | H19 | 119.3° | 120.0° |
| C20 | C19 | H19 | 119.4° | 120.0° |
| C19 | C20 | H20 | 118.7° | 120.0° |
| O25 | C24 | C27 | 123.8° | 120.0° |
| C24 | C27 | C26 | 113.1° | 117.5° |
| C24 | C27 | C28 | 117.9° | 117.5° |
| C24 | C27 | C33 | 111.5° | 115.6° |
| C27 | C26 | C28 | 59.9° | 60.0° |
| C27 | C26 | H26 | 131.0° | 117.5° |
| C27 | C26 | H26A | 131.0° | 117.5° |
| C26 | C27 | C28 | 59.7° | 60.0° |
| C26 | C27 | C33 | 123.0° | 117.5° |
| C28 | C26 | H26 | 130.9° | 117.5° |
| C28 | C26 | H26A | 131.0° | 117.5° |
| C26 | C28 | C27 | 60.4° | 60.0° |
| C26 | C28 | H28 | 130.6° | 117.5° |
| C26 | C28 | H28A | 130.7° | 117.5° |
| H26 | C26 | H26A | 81.7° | 115.5° |
| C28 | C27 | C33 | 122.5° | 117.5° |
| C27 | C28 | H28 | 130.7° | 117.5° |
| C27 | C28 | H28A | 130.7° | 117.5° |
| C27 | C33 | C32 | 118.5° | 120.0° |
| C27 | C33 | C34 | 123.0° | 120.0° |
| H28 | C28 | H28A | 82.2° | 115.6° |
| C30 | C29 | C34 | 119.4° | 120.0° |
| C30 | C29 | H29 | 120.3° | 120.0° |
| C29 | C30 | C31 | 120.6° | 120.0° |
| C29 | C30 | C35 | 121.0° | 120.0° |
| C34 | C29 | H29 | 120.3° | 120.1° |
| C29 | C34 | C33 | 120.4° | 120.0° |
| C29 | C34 | H34 | 119.8° | 120.0° |
| C31 | C30 | C35 | 118.3° | 120.0° |
| C30 | C31 | C32 | 119.5° | 120.0° |
| C30 | C31 | H31 | 120.2° | 120.0° |
| C30 | C35 | F36 | 115.4° | 109.5° |
| C30 | C35 | F37 | 114.9° | 109.4° |
| C30 | C35 | F38 | 112.2° | 109.5° |
| C32 | C31 | H31 | 120.3° | 120.0° |
| C31 | C32 | C33 | 121.6° | 119.9° |
| C31 | C32 | H32 | 119.2° | 120.0° |
| C33 | C32 | H32 | 119.2° | 120.0° |
| C32 | C33 | C34 | 118.5° | 120.0° |
| C33 | C34 | H34 | 119.8° | 120.0° |
| F36 | C35 | F37 | 102.6° | 109.5° |
| F36 | C35 | F38 | 104.1° | 109.5° |
| F37 | C35 | F38 | 106.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N10 | C13 | 118.9° | 119.4° |
| C2 | C1 | N10 | H1 | 117.7° | 121.0° |
| C2 | C1 | C13 | H1 | 117.6° | 121.1° |
| C1 | C2 | N3 | O6 | 177.0° | 180.0° |
| C1 | C2 | N3 | C4 | 176.6° | 180.0° |
| C1 | C2 | N3 | HN3 | 3.4° | 0.0° |
| C2 | C1 | N10 | C11 | 127.7° | 120.5° |
| C2 | C1 | N10 | C24 | 66.4° | 59.6° |
| C2 | C1 | C13 | C12 | 151.7° | 97.2° |
| C2 | C1 | C13 | H13 | 31.7° | 21.1° |
| C2 | C1 | C13 | H13A | 88.3° | 144.5° |
| N10 | C1 | C13 | H1 | 119.2° | 119.5° |
| N10 | C1 | C2 | N3 | 125.5° | 180.0° |
| N10 | C1 | C2 | O6 | 57.4° | 0.0° |
| C1 | N10 | C11 | C24 | 164.5° | 179.9° |
| C1 | N10 | C11 | C12 | 14.3° | 24.2° |
| C1 | N10 | C11 | H11 | 134.3° | 94.7° |
| C1 | N10 | C11 | H11A | 105.7° | 142.9° |
| N10 | C1 | C13 | C12 | 28.6° | 22.1° |
| N10 | C1 | C13 | H13 | 91.4° | 140.5° |
| N10 | C1 | C13 | H13A | 148.6° | 96.2° |
| C1 | N10 | C24 | O25 | 2.3° | 1.0° |
| C1 | N10 | C24 | C27 | 176.9° | 179.0° |
| C13 | C1 | C2 | N3 | 117.1° | 62.2° |
| C13 | C1 | C2 | O6 | 60.0° | 117.8° |
| C13 | C1 | N10 | C11 | 8.8° | 1.1° |
| C13 | C1 | N10 | C24 | 174.7° | 179.0° |
| C1 | C13 | C12 | C11 | 36.1° | 35.5° |
| C1 | C13 | C12 | H13 | 120.0° | 118.4° |
| C1 | C13 | C12 | H13A | 120.0° | 118.3° |
| C1 | C13 | C12 | S14 | 87.4° | 153.6° |
| C1 | C13 | C12 | H12 | 156.7° | 82.6° |
| C1 | C13 | H13 | H13A | 122.4° | 123.2° |
| H1 | C1 | C2 | N3 | 6.3° | 59.0° |
| H1 | C1 | C2 | O6 | 176.6° | 121.0° |
| H1 | C1 | N10 | C11 | 114.7° | 118.5° |
| H1 | C1 | N10 | C24 | 51.3° | 61.4° |
| H1 | C1 | C13 | C12 | 90.6° | 141.7° |
| H1 | C1 | C13 | H13 | 149.3° | 99.9° |
| H1 | C1 | C13 | H13A | 29.4° | 23.4° |
| C2 | N3 | C4 | HN3 | 180.0° | 180.0° |
| C2 | N3 | C4 | C5 | 91.7° | 34.4° |
| C2 | N3 | C4 | C7 | 53.9° | 179.9° |
| C2 | N3 | C4 | C8 | 124.0° | 111.2° |
| O6 | C2 | N3 | C4 | 0.4° | 0.0° |
| O6 | C2 | N3 | HN3 | 179.6° | 180.0° |
| N3 | C4 | C5 | C7 | 147.5° | 145.7° |
| N3 | C4 | C5 | C8 | 144.8° | 145.6° |
| N3 | C4 | C7 | C8 | 107.8° | 107.5° |
| N3 | C4 | C5 | N9 | 172.5° | 25.6° |
| N3 | C4 | C7 | H7 | 132.2° | 145.0° |
| N3 | C4 | C7 | H7A | 12.2° | 0.0° |
| N3 | C4 | C8 | H8 | 8.1° | 0.1° |
| N3 | C4 | C8 | H8A | 128.1° | 145.0° |
| N3 | C4 | C5 | H5 | 7.5° | 154.5° |
| HN3 | N3 | C4 | C5 | 88.3° | 145.6° |
| HN3 | N3 | C4 | C7 | 126.0° | 0.1° |
| HN3 | N3 | C4 | C8 | 56.0° | 68.8° |
| C5 | C4 | C7 | C8 | 108.5° | 107.5° |
| C4 | C5 | N9 | H5 | 180.0° | 179.9° |
| C5 | C4 | C7 | H7 | 11.5° | 0.0° |
| C5 | C4 | C7 | H7A | 131.6° | 145.0° |
| C5 | C4 | C8 | H8 | 133.6° | 145.0° |
| C5 | C4 | C8 | H8A | 13.6° | 0.1° |
| C4 | C5 | N9 | H9 | 180.0° | 179.9° |
| C7 | C4 | C5 | N9 | 40.0° | 120.1° |
| C4 | C7 | C8 | H7 | 120.0° | 107.4° |
| C4 | C7 | C8 | H7A | 120.0° | 107.5° |
| C4 | C7 | H7 | H7A | 138.5° | 145.7° |
| C7 | C4 | C8 | H8 | 120.0° | 107.5° |
| C7 | C4 | C8 | H8A | 120.0° | 107.5° |
| C7 | C4 | C5 | H5 | 140.0° | 59.8° |
| C8 | C4 | C5 | N9 | 27.8° | 171.2° |
| C4 | C8 | H8 | H8A | 138.4° | 145.8° |
| C8 | C4 | C5 | H5 | 152.3° | 8.9° |
| C8 | C7 | H7 | H7A | 138.4° | 145.8° |
| C7 | C8 | H8 | H8A | 138.4° | 145.6° |
| H7 | C7 | C8 | H8 | 120.0° | 145.0° |
| H7 | C7 | C8 | H8A | 0.1° | 0.1° |
| H7A | C7 | C8 | H8 | 0.0° | 0.1° |
| H7A | C7 | C8 | H8A | 119.9° | 145.0° |
| N10 | C11 | C12 | H11 | 120.0° | 118.9° |
| N10 | C11 | C12 | H11A | 120.0° | 118.8° |
| N10 | C11 | H11 | H11A | 121.9° | 122.4° |
| N10 | C11 | C12 | C13 | 31.3° | 37.0° |
| N10 | C11 | C12 | S14 | 88.5° | 155.1° |
| N10 | C11 | C12 | H12 | 155.5° | 81.0° |
| C11 | N10 | C24 | O25 | 165.6° | 178.8° |
| C11 | N10 | C24 | C27 | 13.5° | 1.1° |
| C24 | N10 | C11 | C12 | 150.2° | 155.9° |
| C24 | N10 | C11 | H11 | 30.2° | 85.2° |
| C24 | N10 | C11 | H11A | 89.8° | 37.2° |
| N10 | C24 | O25 | C27 | 179.1° | 180.0° |
| N10 | C24 | C27 | C26 | 87.3° | 123.0° |
| N10 | C24 | C27 | C28 | 154.1° | 54.4° |
| N10 | C24 | C27 | C33 | 56.3° | 91.3° |
| C12 | C11 | H11 | H11A | 121.9° | 122.2° |
| C11 | C12 | C13 | S14 | 123.6° | 118.1° |
| C11 | C12 | C13 | H12 | 120.5° | 118.1° |
| C11 | C12 | S14 | H12 | 120.7° | 124.0° |
| C11 | C12 | C13 | H13 | 83.9° | 153.9° |
| C11 | C12 | C13 | H13A | 156.1° | 82.8° |
| C11 | C12 | S14 | C15 | 60.6° | 169.6° |
| C11 | C12 | S14 | O22 | 178.2° | 78.7° |
| C11 | C12 | S14 | O23 | 53.8° | 58.0° |
| H11 | C11 | C12 | C13 | 151.3° | 81.9° |
| H11 | C11 | C12 | S14 | 31.5° | 36.1° |
| H11 | C11 | C12 | H12 | 84.5° | 160.1° |
| H11A | C11 | C12 | C13 | 88.7° | 155.8° |
| H11A | C11 | C12 | S14 | 151.5° | 86.1° |
| H11A | C11 | C12 | H12 | 35.5° | 37.8° |
| C13 | C12 | S14 | H12 | 124.2° | 123.8° |
| C12 | C13 | H13 | H13A | 122.4° | 123.2° |
| C13 | C12 | S14 | C15 | 175.7° | 78.2° |
| C13 | C12 | S14 | O22 | 66.7° | 33.4° |
| C13 | C12 | S14 | O23 | 61.3° | 170.2° |
| S14 | C12 | C13 | H13 | 152.6° | 88.0° |
| S14 | C12 | C13 | H13A | 32.6° | 35.3° |
| C12 | S14 | C15 | O22 | 114.1° | 116.1° |
| C12 | S14 | C15 | O23 | 114.5° | 116.0° |
| C12 | S14 | O22 | O23 | 121.7° | 131.5° |
| C12 | S14 | C15 | C16 | 71.9° | 68.0° |
| C12 | S14 | C15 | C20 | 106.8° | 111.7° |
| H12 | C12 | C13 | H13 | 36.7° | 35.8° |
| H12 | C12 | C13 | H13A | 83.3° | 159.1° |
| H12 | C12 | S14 | C15 | 60.1° | 45.6° |
| H12 | C12 | S14 | O22 | 57.6° | 157.3° |
| H12 | C12 | S14 | O23 | 174.5° | 66.0° |
| C15 | S14 | O22 | O23 | 125.9° | 116.7° |
| S14 | C15 | C16 | C20 | 178.8° | 179.6° |
| S14 | C15 | C16 | C17 | 179.9° | 179.9° |
| S14 | C15 | C16 | CL | 1.6° | 0.1° |
| S14 | C15 | C20 | C19 | 179.4° | 179.8° |
| S14 | C15 | C20 | H20 | 0.6° | 0.1° |
| O22 | S14 | C15 | C16 | 42.2° | 175.9° |
| O22 | S14 | C15 | C20 | 139.1° | 4.5° |
| O23 | S14 | C15 | C16 | 173.6° | 48.1° |
| O23 | S14 | C15 | C20 | 7.7° | 132.3° |
| C15 | C16 | C17 | CL | 178.4° | 180.0° |
| C15 | C16 | C17 | C18 | 1.6° | 0.0° |
| C15 | C16 | C17 | H17 | 178.4° | 180.0° |
| C16 | C15 | C20 | C19 | 0.5° | 0.5° |
| C16 | C15 | C20 | H20 | 179.5° | 179.7° |
| C20 | C15 | C16 | C17 | 1.3° | 0.3° |
| C20 | C15 | C16 | CL | 179.5° | 179.7° |
| C15 | C20 | C19 | C18 | 0.1° | 0.5° |
| C15 | C20 | C19 | H20 | 180.0° | 179.7° |
| C15 | C20 | C19 | H19 | 179.9° | 179.6° |
| C16 | C17 | C18 | H17 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 1.0° | 0.1° |
| C16 | C17 | C18 | H18 | 179.0° | 180.0° |
| CL | C16 | C17 | C18 | 179.9° | 180.0° |
| CL | C16 | C17 | H17 | 0.0° | 0.0° |
| C17 | C18 | C19 | H18 | 180.0° | 179.9° |
| C17 | C18 | C19 | C20 | 0.3° | 0.2° |
| C17 | C18 | C19 | H19 | 179.7° | 179.9° |
| H17 | C17 | C18 | C19 | 179.0° | 179.9° |
| H17 | C17 | C18 | H18 | 1.0° | 0.0° |
| C18 | C19 | C20 | H19 | 180.0° | 179.9° |
| C18 | C19 | C20 | H20 | 179.9° | 179.8° |
| H18 | C18 | C19 | C20 | 179.6° | 179.7° |
| H18 | C18 | C19 | H19 | 0.4° | 0.1° |
| H19 | C19 | C20 | H20 | 0.1° | 0.1° |
| O25 | C24 | C27 | C26 | 91.8° | 57.1° |
| O25 | C24 | C27 | C28 | 25.0° | 125.7° |
| O25 | C24 | C27 | C33 | 124.6° | 88.6° |
| C24 | C27 | C26 | C28 | 109.9° | 107.4° |
| C24 | C27 | C26 | C33 | 138.8° | 145.0° |
| C24 | C27 | C26 | H26 | 130.1° | 145.0° |
| C24 | C27 | C26 | H26A | 10.1° | 0.0° |
| C24 | C27 | C28 | C33 | 146.0° | 145.0° |
| C24 | C27 | C28 | H28 | 138.2° | 145.0° |
| C24 | C27 | C28 | H28A | 18.1° | 0.0° |
| C24 | C27 | C33 | C32 | 56.3° | 61.8° |
| C24 | C27 | C33 | C34 | 122.4° | 118.2° |
| C27 | C26 | C28 | H26 | 120.0° | 107.5° |
| C27 | C26 | C28 | H26A | 120.0° | 107.5° |
| C27 | C26 | H26 | H26A | 138.6° | 145.7° |
| C26 | C27 | C28 | C33 | 112.1° | 107.5° |
| C27 | C26 | C28 | H28 | 120.0° | 107.5° |
| C27 | C26 | C28 | H28A | 120.0° | 107.5° |
| C26 | C27 | C33 | C32 | 164.3° | 152.5° |
| C26 | C27 | C33 | C34 | 17.0° | 27.5° |
| C28 | C26 | H26 | H26A | 138.6° | 145.7° |
| C26 | C28 | H28 | H28A | 138.5° | 145.7° |
| H26 | C26 | C27 | C33 | 8.7° | 0.0° |
| H26 | C26 | C28 | H28 | 0.0° | 0.0° |
| H26 | C26 | C28 | H28A | 120.0° | 145.0° |
| H26A | C26 | C27 | C33 | 128.7° | 145.0° |
| H26A | C26 | C28 | H28 | 120.0° | 145.0° |
| H26A | C26 | C28 | H28A | 0.0° | 0.0° |
| C27 | C28 | H28 | H28A | 138.5° | 145.7° |
| C28 | C27 | C33 | C32 | 91.7° | 83.9° |
| C28 | C27 | C33 | C34 | 89.6° | 96.1° |
| C33 | C27 | C28 | H28 | 7.8° | 0.0° |
| C33 | C27 | C28 | H28A | 127.9° | 145.0° |
| C27 | C33 | C34 | C29 | 178.0° | 180.0° |
| C27 | C33 | C32 | C31 | 178.7° | 180.0° |
| C27 | C33 | C32 | C34 | 178.7° | 180.0° |
| C27 | C33 | C32 | H32 | 1.3° | 0.0° |
| C27 | C33 | C34 | H34 | 2.0° | 0.0° |
| C30 | C29 | C34 | H29 | 180.0° | 179.7° |
| C29 | C30 | C31 | C35 | 178.8° | 180.0° |
| C29 | C30 | C31 | C32 | 0.7° | 0.0° |
| C29 | C30 | C31 | H31 | 179.4° | 180.0° |
| C30 | C29 | C34 | C33 | 0.7° | 0.0° |
| C30 | C29 | C34 | H34 | 179.3° | 180.0° |
| C29 | C30 | C35 | F36 | 159.8° | 90.0° |
| C29 | C30 | C35 | F37 | 40.6° | 150.0° |
| C29 | C30 | C35 | F38 | 81.2° | 30.0° |
| C34 | C29 | C30 | C31 | 0.0° | 0.0° |
| C34 | C29 | C30 | C35 | 178.8° | 180.0° |
| C29 | C34 | C33 | C32 | 0.7° | 0.0° |
| C29 | C34 | C33 | H34 | 180.0° | 180.0° |
| H29 | C29 | C30 | C31 | 180.0° | 179.7° |
| H29 | C29 | C30 | C35 | 1.2° | 0.3° |
| H29 | C29 | C34 | C33 | 179.3° | 179.7° |
| H29 | C29 | C34 | H34 | 0.7° | 0.3° |
| C30 | C31 | C32 | H31 | 180.0° | 179.9° |
| C30 | C31 | C32 | C33 | 0.7° | 0.0° |
| C30 | C31 | C32 | H32 | 179.4° | 180.0° |
| C31 | C30 | C35 | F36 | 21.4° | 90.0° |
| C31 | C30 | C35 | F37 | 140.5° | 30.0° |
| C31 | C30 | C35 | F38 | 97.6° | 150.0° |
| C35 | C30 | C31 | C32 | 179.5° | 180.0° |
| C35 | C30 | C31 | H31 | 0.5° | 0.1° |
| C30 | C35 | F36 | F37 | 125.7° | 120.0° |
| C30 | C35 | F36 | F38 | 123.4° | 120.0° |
| C30 | C35 | F37 | F38 | 124.9° | 120.0° |
| C31 | C32 | C33 | H32 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.0° | 0.0° |
| H31 | C31 | C32 | C33 | 179.4° | 180.0° |
| H31 | C31 | C32 | H32 | 0.6° | 0.0° |
| C32 | C33 | C34 | H34 | 179.3° | 180.0° |
| H32 | C32 | C33 | C34 | 180.0° | 180.0° |
| F36 | C35 | F37 | F38 | 109.1° | 120.0° |
| H5 | C5 | N9 | H9 | 0.0° | 0.0° |
