A1JN1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | N16 | doub | 1.32Å | 1.32Å | Aromatic |
| C17 | C18 | sing | 1.40Å | 1.40Å | Aromatic |
| N16 | C15 | sing | 1.32Å | 1.32Å | Aromatic |
| O21 | C20 | doub | 1.22Å | 1.23Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C20 | C18 | sing | 1.48Å | 1.49Å | |
| C20 | N22 | sing | 1.35Å | 1.36Å | |
| C18 | C19 | doub | 1.40Å | 1.41Å | Aromatic |
| C15 | C14 | doub | 1.39Å | 1.41Å | Aromatic |
| C23 | N22 | sing | 1.47Å | 1.47Å | |
| C19 | C14 | sing | 1.39Å | 1.40Å | Aromatic |
| C14 | N11 | sing | 1.40Å | 1.41Å | |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.41Å | Aromatic |
| C10 | N11 | sing | 1.47Å | 1.48Å | |
| C10 | C8 | sing | 1.54Å | 1.53Å | |
| C3 | C4 | sing | 1.38Å | 1.37Å | Aromatic |
| N11 | C12 | sing | 1.48Å | 1.49Å | |
| C8 | C7 | sing | 1.51Å | 1.52Å | |
| C8 | C13 | sing | 1.55Å | 1.55Å | |
| C7 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.55Å | 1.53Å | |
| C4 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| C5 | C24 | sing | 1.48Å | 1.50Å | |
| C24 | N26 | sing | 1.35Å | 1.36Å | |
| C24 | O25 | doub | 1.21Å | 1.23Å | |
| N26 | C27 | sing | 1.40Å | 1.40Å | |
| C27 | C28 | doub | 1.39Å | 1.41Å | Aromatic |
| C27 | C32 | sing | 1.39Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| F36 | C33 | sing | 1.40Å | 1.40Å | |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C33 | sing | 1.51Å | 1.51Å | |
| C31 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
| C33 | F34 | sing | 1.40Å | 1.38Å | |
| C33 | F35 | sing | 1.40Å | 1.40Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.08Å | 1.08Å | |
| N22 | H13 | sing | 0.97Å | 1.00Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C30 | H17 | sing | 1.08Å | 1.08Å | |
| C31 | H18 | sing | 1.08Å | 1.08Å | |
| C32 | H19 | sing | 1.08Å | 1.08Å | |
| C10 | H20 | sing | 1.09Å | 1.10Å | |
| C10 | H21 | sing | 1.09Å | 1.10Å | |
| C13 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.09Å | 1.10Å | |
| N26 | H24 | sing | 0.97Å | 1.00Å | |
| C28 | H25 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N16 | C17 | C18 | 121.3° | 120.7° |
| C17 | N16 | C15 | 122.4° | 122.0° |
| N16 | C17 | H11 | 119.3° | 119.6° |
| C17 | C18 | C20 | 120.9° | 120.5° |
| C17 | C18 | C19 | 117.6° | 119.0° |
| C18 | C17 | H11 | 119.4° | 119.6° |
| N16 | C15 | C14 | 121.0° | 121.0° |
| N16 | C15 | H10 | 119.5° | 119.5° |
| O21 | C20 | C18 | 119.3° | 120.0° |
| O21 | C20 | N22 | 119.0° | 120.0° |
| C1 | C2 | C3 | 116.3° | 119.8° |
| C1 | C2 | C7 | 124.0° | 119.9° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| C18 | C20 | N22 | 121.7° | 120.0° |
| C20 | C18 | C19 | 121.5° | 120.5° |
| C20 | N22 | C23 | 121.1° | 120.0° |
| C20 | N22 | H13 | 119.5° | 120.0° |
| C18 | C19 | C14 | 119.9° | 118.2° |
| C18 | C19 | H12 | 120.0° | 120.9° |
| C15 | C14 | C19 | 117.8° | 119.1° |
| C15 | C14 | N11 | 121.4° | 120.4° |
| C14 | C15 | H10 | 119.5° | 119.5° |
| C23 | N22 | H13 | 119.4° | 120.0° |
| N22 | C23 | H14 | 109.5° | 109.4° |
| N22 | C23 | H15 | 109.5° | 109.4° |
| N22 | C23 | H16 | 109.5° | 109.4° |
| C19 | C14 | N11 | 120.8° | 120.4° |
| C14 | C19 | H12 | 120.0° | 120.9° |
| C14 | N11 | C10 | 120.0° | 111.0° |
| C14 | N11 | C12 | 119.3° | 111.0° |
| C3 | C2 | C7 | 119.7° | 120.3° |
| C2 | C3 | C4 | 120.7° | 120.1° |
| C2 | C3 | H4 | 119.7° | 119.9° |
| C2 | C7 | C8 | 119.2° | 119.9° |
| C2 | C7 | C6 | 119.1° | 120.1° |
| N11 | C10 | C8 | 103.8° | 107.3° |
| C10 | N11 | C12 | 109.7° | 108.6° |
| N11 | C10 | H20 | 110.9° | 109.9° |
| N11 | C10 | H21 | 110.8° | 110.0° |
| C10 | C8 | C7 | 113.2° | 110.7° |
| C10 | C8 | C13 | 104.0° | 103.0° |
| C10 | C8 | H7 | 107.9° | 110.9° |
| C8 | C10 | H20 | 110.8° | 109.8° |
| C8 | C10 | H21 | 110.9° | 109.9° |
| C3 | C4 | C5 | 121.9° | 119.9° |
| C4 | C3 | H4 | 119.7° | 119.9° |
| C3 | C4 | H5 | 119.1° | 120.1° |
| N11 | C12 | C13 | 101.2° | 104.8° |
| N11 | C12 | H8 | 111.5° | 110.4° |
| N11 | C12 | H9 | 111.5° | 110.5° |
| C7 | C8 | C13 | 115.5° | 110.7° |
| C8 | C7 | C6 | 121.7° | 120.0° |
| C7 | C8 | H7 | 108.1° | 110.6° |
| C8 | C13 | C12 | 99.5° | 101.6° |
| C13 | C8 | H7 | 107.8° | 110.7° |
| C8 | C13 | H22 | 111.9° | 111.0° |
| C8 | C13 | H23 | 111.9° | 111.0° |
| C7 | C6 | C5 | 121.5° | 119.9° |
| C7 | C6 | H6 | 119.2° | 120.0° |
| C13 | C12 | H8 | 111.5° | 110.3° |
| C13 | C12 | H9 | 111.5° | 110.4° |
| C12 | C13 | H22 | 111.9° | 111.0° |
| C12 | C13 | H23 | 111.9° | 111.0° |
| C4 | C5 | C6 | 117.1° | 119.7° |
| C4 | C5 | C24 | 122.1° | 120.2° |
| C5 | C4 | H5 | 119.0° | 120.1° |
| C6 | C5 | C24 | 120.6° | 120.1° |
| C5 | C6 | H6 | 119.3° | 120.1° |
| C5 | C24 | N26 | 121.7° | 120.0° |
| C5 | C24 | O25 | 118.6° | 120.0° |
| N26 | C24 | O25 | 119.6° | 120.0° |
| C24 | N26 | C27 | 126.5° | 120.0° |
| C24 | N26 | H24 | 116.8° | 120.0° |
| N26 | C27 | C28 | 121.9° | 120.1° |
| N26 | C27 | C32 | 118.8° | 120.1° |
| C27 | N26 | H24 | 116.8° | 120.0° |
| C28 | C27 | C32 | 119.0° | 119.8° |
| C27 | C28 | C29 | 120.7° | 119.9° |
| C27 | C28 | H25 | 119.6° | 120.0° |
| C27 | C32 | C31 | 120.2° | 120.0° |
| C27 | C32 | H19 | 119.9° | 120.0° |
| C28 | C29 | C30 | 119.2° | 120.1° |
| C28 | C29 | C33 | 120.4° | 119.9° |
| C29 | C28 | H25 | 119.7° | 120.1° |
| C32 | C31 | C30 | 120.4° | 120.1° |
| C32 | C31 | H18 | 119.8° | 120.0° |
| C31 | C32 | H19 | 119.9° | 120.0° |
| F36 | C33 | C29 | 111.1° | 109.5° |
| F36 | C33 | F34 | 106.8° | 109.5° |
| F36 | C33 | F35 | 110.9° | 109.4° |
| C30 | C29 | C33 | 120.4° | 119.9° |
| C29 | C30 | C31 | 120.4° | 120.1° |
| C29 | C30 | H17 | 119.8° | 120.0° |
| C29 | C33 | F34 | 109.2° | 109.5° |
| C29 | C33 | F35 | 111.9° | 109.5° |
| C31 | C30 | H17 | 119.8° | 119.9° |
| C30 | C31 | H18 | 119.8° | 119.9° |
| F34 | C33 | F35 | 106.7° | 109.5° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H8 | C12 | H9 | 109.5° | 110.4° |
| H14 | C23 | H15 | 109.5° | 109.5° |
| H14 | C23 | H16 | 109.5° | 109.5° |
| H15 | C23 | H16 | 109.5° | 109.5° |
| H20 | C10 | H21 | 109.5° | 110.0° |
| H22 | C13 | H23 | 109.5° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N16 | C17 | C18 | H11 | 180.0° | 180.0° |
| N16 | C17 | C18 | C20 | 179.4° | 180.0° |
| N16 | C17 | C18 | C19 | 0.4° | 0.3° |
| C17 | N16 | C15 | C14 | 0.5° | 0.0° |
| C17 | N16 | C15 | H10 | 179.5° | 179.7° |
| C18 | C17 | N16 | C15 | 0.2° | 0.0° |
| C17 | C18 | C20 | O21 | 17.7° | 180.0° |
| C17 | C18 | C20 | C19 | 178.9° | 179.7° |
| C17 | C18 | C20 | N22 | 162.7° | 0.0° |
| C17 | C18 | C19 | C14 | 1.0° | 0.5° |
| C17 | C18 | C19 | H12 | 179.0° | 180.0° |
| N16 | C15 | C14 | H10 | 180.0° | 179.8° |
| N16 | C15 | C14 | C19 | 1.0° | 0.2° |
| N16 | C15 | C14 | N11 | 178.4° | 179.8° |
| C15 | N16 | C17 | H11 | 179.8° | 180.0° |
| O21 | C20 | C18 | N22 | 179.6° | 180.0° |
| O21 | C20 | C18 | C19 | 161.2° | 0.3° |
| O21 | C20 | N22 | C23 | 0.4° | 0.0° |
| O21 | C20 | N22 | H13 | 179.6° | 179.9° |
| C1 | C2 | C3 | C7 | 178.8° | 179.8° |
| C1 | C2 | C3 | C4 | 179.0° | 180.0° |
| C1 | C2 | C7 | C8 | 2.7° | 0.1° |
| C1 | C2 | C7 | C6 | 179.4° | 179.7° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | C2 | C3 | H4 | 1.0° | 0.1° |
| C18 | C20 | N22 | C23 | 179.9° | 180.0° |
| C20 | C18 | C19 | C14 | 179.9° | 179.8° |
| C20 | C18 | C17 | H11 | 0.6° | 0.0° |
| C20 | C18 | C19 | H12 | 0.1° | 0.4° |
| C18 | C20 | N22 | H13 | 0.0° | 0.0° |
| N22 | C20 | C18 | C19 | 18.4° | 179.7° |
| C20 | N22 | C23 | H13 | 180.0° | 180.0° |
| C20 | N22 | C23 | H14 | 180.0° | 180.0° |
| C20 | N22 | C23 | H15 | 60.0° | 60.0° |
| C20 | N22 | C23 | H16 | 60.0° | 60.0° |
| C18 | C19 | C14 | C15 | 1.3° | 0.5° |
| C18 | C19 | C14 | H12 | 180.0° | 179.4° |
| C18 | C19 | C14 | N11 | 178.7° | 179.5° |
| C19 | C18 | C17 | H11 | 179.6° | 179.7° |
| C15 | C14 | C19 | N11 | 177.4° | 180.0° |
| C15 | C14 | N11 | C10 | 33.2° | 144.0° |
| C15 | C14 | N11 | C12 | 173.6° | 23.1° |
| C15 | C14 | C19 | H12 | 178.7° | 179.9° |
| N22 | C23 | H14 | H15 | 120.0° | 120.0° |
| N22 | C23 | H14 | H16 | 120.0° | 120.0° |
| N22 | C23 | H15 | H16 | 120.0° | 120.0° |
| C19 | C14 | N11 | C10 | 149.5° | 36.0° |
| C19 | C14 | N11 | C12 | 9.1° | 156.9° |
| C19 | C14 | C15 | H10 | 179.0° | 180.0° |
| C14 | N11 | C10 | C12 | 143.8° | 122.3° |
| C14 | N11 | C10 | C8 | 150.2° | 123.2° |
| C14 | N11 | C12 | C13 | 177.0° | 146.4° |
| C14 | N11 | C12 | H8 | 58.3° | 27.6° |
| C14 | N11 | C12 | H9 | 64.4° | 94.8° |
| N11 | C14 | C15 | H10 | 1.6° | 0.0° |
| N11 | C14 | C19 | H12 | 1.4° | 0.1° |
| C14 | N11 | C10 | H20 | 90.7° | 3.9° |
| C14 | N11 | C10 | H21 | 31.1° | 117.3° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| C3 | C2 | C7 | C8 | 178.5° | 179.8° |
| C3 | C2 | C7 | C6 | 0.7° | 0.5° |
| C2 | C3 | C4 | C5 | 1.4° | 0.1° |
| C3 | C2 | C1 | H1 | 89.5° | 90.0° |
| C3 | C2 | C1 | H2 | 150.5° | 150.0° |
| C3 | C2 | C1 | H3 | 30.5° | 30.1° |
| C2 | C3 | C4 | H5 | 178.6° | 180.0° |
| C2 | C7 | C8 | C10 | 84.4° | 125.0° |
| C7 | C2 | C3 | C4 | 0.1° | 0.2° |
| C2 | C7 | C8 | C6 | 177.8° | 179.8° |
| C2 | C7 | C8 | C13 | 155.9° | 121.4° |
| C2 | C7 | C6 | C5 | 0.2° | 0.5° |
| C7 | C2 | C1 | H1 | 89.3° | 90.2° |
| C7 | C2 | C1 | H2 | 30.7° | 29.8° |
| C7 | C2 | C1 | H3 | 150.7° | 149.7° |
| C7 | C2 | C3 | H4 | 179.9° | 179.8° |
| C2 | C7 | C6 | H6 | 179.8° | 179.7° |
| C2 | C7 | C8 | H7 | 35.1° | 1.6° |
| N11 | C10 | C8 | H20 | 119.1° | 119.4° |
| N11 | C10 | C8 | H21 | 119.1° | 119.5° |
| N11 | C10 | C8 | C7 | 148.7° | 140.7° |
| N11 | C10 | C8 | C13 | 22.6° | 22.3° |
| C10 | N11 | C12 | C13 | 32.9° | 24.0° |
| N11 | C10 | C8 | H7 | 91.7° | 96.1° |
| C10 | N11 | C12 | H8 | 85.8° | 94.7° |
| C10 | N11 | C12 | H9 | 151.5° | 142.9° |
| N11 | C10 | H20 | H21 | 122.6° | 121.2° |
| C8 | C10 | N11 | C12 | 6.4° | 0.9° |
| C10 | C8 | C7 | C13 | 119.7° | 113.6° |
| C10 | C8 | C7 | H7 | 119.5° | 123.4° |
| C10 | C8 | C13 | H7 | 114.4° | 118.6° |
| C10 | C8 | C7 | C6 | 97.9° | 54.8° |
| C10 | C8 | C13 | C12 | 41.9° | 35.7° |
| C8 | C10 | H20 | H21 | 122.6° | 121.1° |
| C10 | C8 | C13 | H22 | 76.5° | 82.4° |
| C10 | C8 | C13 | H23 | 160.2° | 153.7° |
| C3 | C4 | C5 | H5 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 2.2° | 0.1° |
| C3 | C4 | C5 | C24 | 177.1° | 179.9° |
| N11 | C12 | C13 | C8 | 44.7° | 37.0° |
| N11 | C12 | C13 | H8 | 118.7° | 118.8° |
| N11 | C12 | C13 | H9 | 118.7° | 119.0° |
| N11 | C12 | H8 | H9 | 123.9° | 122.4° |
| C12 | N11 | C10 | H20 | 125.4° | 118.4° |
| C12 | N11 | C10 | H21 | 112.8° | 120.4° |
| N11 | C12 | C13 | H22 | 73.7° | 81.1° |
| N11 | C12 | C13 | H23 | 163.0° | 155.2° |
| C7 | C8 | C13 | H7 | 121.0° | 123.0° |
| C7 | C8 | C13 | C12 | 166.5° | 154.0° |
| C8 | C7 | C6 | C5 | 177.6° | 179.8° |
| C8 | C7 | C6 | H6 | 2.4° | 0.0° |
| C7 | C8 | C10 | H20 | 29.6° | 100.0° |
| C7 | C8 | C10 | H21 | 92.2° | 21.2° |
| C7 | C8 | C13 | H22 | 48.2° | 35.9° |
| C7 | C8 | C13 | H23 | 75.2° | 87.9° |
| C13 | C8 | C7 | C6 | 21.9° | 58.8° |
| C8 | C13 | C12 | H22 | 118.4° | 118.1° |
| C8 | C13 | C12 | H23 | 118.4° | 118.1° |
| C8 | C13 | C12 | H8 | 74.0° | 81.8° |
| C8 | C13 | C12 | H9 | 163.4° | 156.0° |
| C13 | C8 | C10 | H20 | 96.5° | 141.7° |
| C13 | C8 | C10 | H21 | 141.7° | 97.2° |
| C8 | C13 | H22 | H23 | 124.7° | 123.9° |
| C7 | C6 | C5 | C4 | 1.6° | 0.2° |
| C7 | C6 | C5 | H6 | 180.0° | 179.8° |
| C7 | C6 | C5 | C24 | 176.5° | 179.8° |
| C6 | C7 | C8 | H7 | 142.7° | 178.2° |
| C12 | C13 | C8 | H7 | 72.5° | 82.9° |
| C13 | C12 | H8 | H9 | 123.8° | 122.3° |
| C12 | C13 | H22 | H23 | 124.6° | 123.8° |
| C4 | C5 | C6 | C24 | 174.9° | 180.0° |
| C4 | C5 | C24 | N26 | 14.4° | 0.0° |
| C4 | C5 | C24 | O25 | 160.9° | 180.0° |
| C5 | C4 | C3 | H4 | 178.6° | 180.0° |
| C4 | C5 | C6 | H6 | 178.4° | 180.0° |
| C6 | C5 | C24 | N26 | 170.9° | 180.0° |
| C6 | C5 | C24 | O25 | 13.7° | 0.0° |
| C6 | C5 | C4 | H5 | 177.8° | 180.0° |
| C5 | C24 | N26 | O25 | 175.3° | 180.0° |
| C5 | C24 | N26 | C27 | 175.2° | 174.8° |
| C24 | C5 | C4 | H5 | 2.9° | 0.0° |
| C24 | C5 | C6 | H6 | 3.4° | 0.0° |
| C5 | C24 | N26 | H24 | 4.8° | 5.1° |
| C24 | N26 | C27 | H24 | 180.0° | 180.0° |
| C24 | N26 | C27 | C28 | 46.7° | 147.0° |
| C24 | N26 | C27 | C32 | 139.8° | 33.3° |
| O25 | C24 | N26 | C27 | 0.1° | 5.1° |
| O25 | C24 | N26 | H24 | 179.9° | 174.9° |
| N26 | C27 | C28 | C32 | 173.5° | 179.7° |
| N26 | C27 | C28 | C29 | 176.8° | 179.7° |
| N26 | C27 | C32 | C31 | 176.9° | 179.7° |
| N26 | C27 | C32 | H19 | 3.1° | 0.3° |
| N26 | C27 | C28 | H25 | 3.2° | 0.3° |
| C27 | C28 | C29 | H25 | 180.0° | 180.0° |
| C28 | C27 | C32 | C31 | 3.2° | 0.0° |
| C27 | C28 | C29 | C30 | 1.6° | 0.0° |
| C27 | C28 | C29 | C33 | 177.6° | 180.0° |
| C28 | C27 | C32 | H19 | 176.8° | 180.0° |
| C28 | C27 | N26 | H24 | 133.4° | 33.0° |
| C32 | C27 | C28 | C29 | 3.2° | 0.0° |
| C27 | C32 | C31 | H19 | 180.0° | 180.0° |
| C27 | C32 | C31 | C30 | 1.5° | 0.0° |
| C27 | C32 | C31 | H18 | 178.5° | 180.0° |
| C32 | C27 | N26 | H24 | 40.2° | 146.7° |
| C32 | C27 | C28 | H25 | 176.7° | 180.0° |
| C28 | C29 | C33 | F36 | 34.3° | 30.0° |
| C28 | C29 | C30 | C33 | 179.2° | 180.0° |
| C28 | C29 | C30 | C31 | 0.1° | 0.0° |
| C28 | C29 | C33 | F34 | 83.1° | 90.0° |
| C28 | C29 | C33 | F35 | 158.9° | 150.0° |
| C28 | C29 | C30 | H17 | 180.0° | 180.0° |
| C32 | C31 | C30 | C29 | 0.1° | 0.0° |
| C32 | C31 | C30 | H18 | 180.0° | 180.0° |
| C32 | C31 | C30 | H17 | 179.9° | 180.0° |
| F36 | C33 | C29 | C30 | 146.5° | 150.0° |
| F36 | C33 | C29 | F34 | 117.5° | 120.0° |
| F36 | C33 | C29 | F35 | 124.6° | 120.0° |
| F36 | C33 | F34 | F35 | 118.7° | 120.0° |
| C29 | C30 | C31 | H17 | 180.0° | 180.0° |
| C30 | C29 | C33 | F34 | 96.1° | 90.0° |
| C30 | C29 | C33 | F35 | 21.9° | 30.0° |
| C29 | C30 | C31 | H18 | 179.8° | 180.0° |
| C30 | C29 | C28 | H25 | 178.3° | 180.0° |
| C33 | C29 | C30 | C31 | 179.3° | 180.0° |
| C29 | C33 | F34 | F35 | 121.2° | 120.0° |
| C33 | C29 | C30 | H17 | 0.7° | 0.0° |
| C33 | C29 | C28 | H25 | 2.4° | 0.0° |
| C30 | C31 | C32 | H19 | 178.5° | 180.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C3 | C4 | H5 | 1.4° | 0.1° |
| H7 | C8 | C10 | H20 | 149.2° | 23.3° |
| H7 | C8 | C10 | H21 | 27.4° | 144.4° |
| H7 | C8 | C13 | H22 | 169.1° | 159.0° |
| H7 | C8 | C13 | H23 | 45.8° | 35.1° |
| H8 | C12 | C13 | H22 | 167.6° | 160.1° |
| H8 | C12 | C13 | H23 | 44.4° | 36.4° |
| H9 | C12 | C13 | H22 | 45.0° | 37.9° |
| H9 | C12 | C13 | H23 | 78.3° | 85.9° |
| H13 | N22 | C23 | H14 | 0.0° | 0.0° |
| H13 | N22 | C23 | H15 | 120.0° | 119.9° |
| H13 | N22 | C23 | H16 | 120.0° | 120.0° |
| H14 | C23 | H15 | H16 | 120.0° | 120.1° |
| H17 | C30 | C31 | H18 | 0.1° | 0.0° |
| H18 | C31 | C32 | H19 | 1.5° | 0.0° |
