X2P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C7 | sing | 1.35Å | 1.34Å | |
| O1 | C6 | doub | 1.22Å | 1.22Å | |
| C14 | C15 | sing | 1.54Å | 1.54Å | |
| C14 | C13 | sing | 1.55Å | 1.54Å | |
| C15 | C17 | sing | 1.53Å | 1.49Å | |
| C15 | C16 | sing | 1.54Å | 1.50Å | |
| C6 | C7 | sing | 1.47Å | 1.45Å | |
| C6 | N1 | sing | 1.35Å | 1.40Å | |
| C7 | C2 | doub | 1.38Å | 1.43Å | |
| O4 | C1 | doub | 1.22Å | 1.23Å | |
| CL | C23 | sing | 1.74Å | 1.73Å | |
| C17 | C16 | sing | 1.53Å | 1.50Å | |
| C16 | C8 | sing | 1.53Å | 1.55Å | |
| C13 | C8 | sing | 1.54Å | 1.54Å | |
| N1 | C8 | sing | 1.46Å | 1.50Å | |
| N1 | C5 | sing | 1.38Å | 1.39Å | |
| C1 | C2 | sing | 1.48Å | 1.46Å | |
| C1 | N | sing | 1.35Å | 1.35Å | |
| C2 | C3 | sing | 1.41Å | 1.45Å | |
| C8 | N2 | sing | 1.46Å | 1.48Å | |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | sing | 1.39Å | 1.38Å | Aromatic |
| C5 | C3 | doub | 1.36Å | 1.38Å | |
| C5 | C9 | sing | 1.48Å | 1.45Å | |
| N | C18 | sing | 1.46Å | 1.46Å | |
| N | C | sing | 1.46Å | 1.47Å | |
| C3 | C4 | sing | 1.51Å | 1.50Å | |
| C18 | C19 | sing | 1.51Å | 1.51Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| N2 | C9 | sing | 1.35Å | 1.36Å | |
| N2 | C10 | sing | 1.46Å | 1.47Å | |
| C22 | F | sing | 1.35Å | 1.36Å | |
| C22 | C21 | doub | 1.38Å | 1.37Å | Aromatic |
| C9 | O2 | doub | 1.22Å | 1.23Å | |
| C | C4 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.53Å | 1.56Å | |
| O3 | C11 | sing | 1.43Å | 1.44Å | |
| C20 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| C17 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.08Å | 1.08Å | |
| C21 | H11 | sing | 1.08Å | 1.08Å | |
| C24 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| O | H15 | sing | 0.97Å | 0.95Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.09Å | 1.10Å | |
| O3 | H20 | sing | 0.97Å | 0.95Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C | H24 | sing | 1.09Å | 1.10Å | |
| C | H25 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C7 | C6 | 113.3° | 120.9° |
| O | C7 | C2 | 121.1° | 120.9° |
| C7 | O | H15 | 109.5° | 114.0° |
| O1 | C6 | C7 | 120.7° | 120.3° |
| O1 | C6 | N1 | 122.9° | 120.2° |
| C15 | C14 | C13 | 107.0° | 104.3° |
| C14 | C15 | C17 | 118.2° | 118.1° |
| C14 | C15 | C16 | 108.8° | 106.5° |
| C14 | C15 | H7 | 118.1° | 117.8° |
| C15 | C14 | H17 | 110.1° | 110.5° |
| C15 | C14 | H18 | 110.1° | 110.5° |
| C14 | C13 | C8 | 105.9° | 102.7° |
| C14 | C13 | H5 | 110.4° | 110.8° |
| C14 | C13 | H6 | 110.4° | 111.0° |
| C13 | C14 | H17 | 110.1° | 110.4° |
| C13 | C14 | H18 | 110.1° | 110.4° |
| C17 | C15 | C16 | 60.1° | 59.8° |
| C15 | C17 | C16 | 60.1° | 60.5° |
| C17 | C15 | H7 | 119.0° | 119.3° |
| C15 | C17 | H8 | 120.0° | 117.4° |
| C15 | C17 | H9 | 120.0° | 117.5° |
| C15 | C16 | C17 | 59.8° | 59.8° |
| C15 | C16 | C8 | 107.3° | 106.4° |
| C16 | C15 | H7 | 118.9° | 121.3° |
| C15 | C16 | H16 | 118.3° | 121.0° |
| C7 | C6 | N1 | 116.5° | 119.5° |
| C6 | C7 | C2 | 125.6° | 118.2° |
| C6 | N1 | C8 | 126.9° | 131.9° |
| C6 | N1 | C5 | 118.8° | 121.2° |
| C7 | C2 | C1 | 122.8° | 121.4° |
| C7 | C2 | C3 | 114.6° | 119.6° |
| O4 | C1 | C2 | 122.5° | 120.4° |
| O4 | C1 | N | 122.6° | 120.4° |
| CL | C23 | C24 | 120.2° | 120.0° |
| CL | C23 | C22 | 119.9° | 120.0° |
| C17 | C16 | C8 | 121.2° | 118.7° |
| C16 | C17 | H8 | 120.0° | 117.4° |
| C16 | C17 | H9 | 120.0° | 117.4° |
| C17 | C16 | H16 | 118.3° | 119.1° |
| C16 | C8 | C13 | 106.7° | 105.1° |
| C16 | C8 | N1 | 111.7° | 111.1° |
| C16 | C8 | N2 | 117.2° | 111.4° |
| C8 | C16 | H16 | 117.2° | 117.8° |
| C13 | C8 | N1 | 113.3° | 110.7° |
| C13 | C8 | N2 | 111.4° | 110.9° |
| C8 | C13 | H5 | 110.3° | 110.8° |
| C8 | C13 | H6 | 110.3° | 110.8° |
| C8 | N1 | C5 | 114.2° | 106.9° |
| N1 | C8 | N2 | 96.6° | 107.7° |
| N1 | C5 | C3 | 125.5° | 120.9° |
| N1 | C5 | C9 | 106.0° | 108.3° |
| C2 | C1 | N | 114.9° | 119.3° |
| C1 | C2 | C3 | 122.6° | 119.0° |
| C1 | N | C18 | 119.8° | 119.4° |
| C1 | N | C | 121.7° | 121.1° |
| C2 | C3 | C5 | 119.0° | 120.6° |
| C2 | C3 | C4 | 118.5° | 119.0° |
| C8 | N2 | C9 | 116.4° | 107.7° |
| C8 | N2 | C10 | 121.1° | 126.2° |
| C23 | C24 | C19 | 120.2° | 120.0° |
| C24 | C23 | C22 | 119.8° | 120.0° |
| C23 | C24 | H12 | 119.9° | 120.0° |
| C24 | C19 | C18 | 120.9° | 120.0° |
| C24 | C19 | C20 | 118.6° | 120.1° |
| C19 | C24 | H12 | 119.9° | 119.9° |
| C23 | C22 | F | 119.3° | 120.1° |
| C23 | C22 | C21 | 121.2° | 119.9° |
| C3 | C5 | C9 | 128.4° | 130.8° |
| C5 | C3 | C4 | 122.5° | 120.4° |
| C5 | C9 | N2 | 105.9° | 109.3° |
| C5 | C9 | O2 | 129.8° | 125.3° |
| C18 | N | C | 116.1° | 119.4° |
| N | C18 | C19 | 113.9° | 109.5° |
| N | C18 | H13 | 108.4° | 109.5° |
| N | C18 | H14 | 108.3° | 109.5° |
| N | C | C4 | 111.0° | 111.2° |
| N | C | H24 | 109.1° | 109.2° |
| N | C | H25 | 109.1° | 109.1° |
| C3 | C4 | C | 109.6° | 110.0° |
| C3 | C4 | H1 | 109.4° | 109.4° |
| C3 | C4 | H2 | 109.4° | 109.4° |
| C18 | C19 | C20 | 120.5° | 119.9° |
| C19 | C18 | H13 | 108.3° | 109.5° |
| C19 | C18 | H14 | 108.3° | 109.4° |
| C19 | C20 | C21 | 121.3° | 120.0° |
| C19 | C20 | H10 | 119.4° | 120.0° |
| C9 | N2 | C10 | 122.4° | 126.1° |
| N2 | C9 | O2 | 124.3° | 125.3° |
| N2 | C10 | C11 | 114.8° | 109.5° |
| N2 | C10 | H3 | 108.1° | 109.5° |
| N2 | C10 | H4 | 108.1° | 109.4° |
| F | C22 | C21 | 119.4° | 120.0° |
| C22 | C21 | C20 | 118.9° | 120.0° |
| C22 | C21 | H11 | 120.6° | 120.0° |
| C | C4 | H1 | 109.5° | 109.4° |
| C | C4 | H2 | 109.4° | 109.3° |
| C4 | C | H24 | 109.1° | 109.1° |
| C4 | C | H25 | 109.1° | 109.2° |
| C10 | C11 | O3 | 110.1° | 109.5° |
| C10 | C11 | C12 | 110.8° | 109.5° |
| C11 | C10 | H3 | 108.1° | 109.5° |
| C11 | C10 | H4 | 108.1° | 109.5° |
| C10 | C11 | H19 | 107.8° | 109.5° |
| O3 | C11 | C12 | 110.2° | 109.5° |
| O3 | C11 | H19 | 109.4° | 109.4° |
| C11 | O3 | H20 | 109.5° | 113.9° |
| C21 | C20 | H10 | 119.3° | 120.0° |
| C20 | C21 | H11 | 120.6° | 120.0° |
| C12 | C11 | H19 | 108.4° | 109.4° |
| C11 | C12 | H21 | 109.5° | 109.5° |
| C11 | C12 | H22 | 109.5° | 109.5° |
| C11 | C12 | H23 | 109.4° | 109.4° |
| H1 | C4 | H2 | 109.4° | 109.4° |
| H3 | C10 | H4 | 109.5° | 109.4° |
| H5 | C13 | H6 | 109.5° | 110.6° |
| H8 | C17 | H9 | 109.5° | 115.5° |
| H13 | C18 | H14 | 109.5° | 109.5° |
| H17 | C14 | H18 | 109.5° | 110.5° |
| H21 | C12 | H22 | 109.4° | 109.4° |
| H21 | C12 | H23 | 109.4° | 109.5° |
| H22 | C12 | H23 | 109.5° | 109.5° |
| H24 | C | H25 | 109.5° | 109.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C7 | C6 | O1 | 0.3° | 0.3° |
| O | C7 | C6 | C2 | 179.5° | 179.9° |
| O | C7 | C6 | N1 | 179.7° | 179.6° |
| O | C7 | C2 | C1 | 0.5° | 0.7° |
| O | C7 | C2 | C3 | 178.3° | 178.2° |
| O1 | C6 | C7 | N1 | 179.4° | 180.0° |
| O1 | C6 | C7 | C2 | 179.2° | 179.7° |
| O1 | C6 | N1 | C8 | 6.8° | 1.5° |
| O1 | C6 | N1 | C5 | 177.4° | 178.2° |
| C15 | C14 | C13 | H17 | 119.6° | 118.7° |
| C15 | C14 | C13 | H18 | 119.6° | 118.7° |
| C14 | C15 | C17 | C16 | 96.5° | 93.6° |
| C14 | C15 | C17 | H7 | 155.0° | 155.1° |
| C14 | C15 | C16 | H7 | 139.0° | 138.7° |
| C14 | C15 | C16 | C8 | 4.1° | 0.8° |
| C15 | C14 | C13 | C8 | 18.7° | 37.2° |
| C15 | C14 | C13 | H5 | 100.7° | 81.1° |
| C15 | C14 | C13 | H6 | 138.1° | 155.7° |
| C14 | C15 | C17 | H8 | 154.1° | 158.8° |
| C14 | C15 | C17 | H9 | 13.0° | 14.0° |
| C14 | C15 | C16 | H16 | 139.6° | 138.9° |
| C15 | C14 | H17 | H18 | 121.1° | 122.6° |
| C13 | C14 | C15 | C17 | 56.4° | 87.8° |
| C13 | C14 | C15 | C16 | 9.1° | 23.7° |
| C14 | C13 | C8 | C16 | 21.2° | 37.0° |
| C14 | C13 | C8 | H5 | 119.4° | 118.3° |
| C14 | C13 | C8 | H6 | 119.5° | 118.5° |
| C14 | C13 | C8 | N1 | 102.2° | 157.0° |
| C14 | C13 | C8 | N2 | 150.2° | 83.5° |
| C14 | C13 | H5 | H6 | 121.7° | 123.4° |
| C13 | C14 | C15 | H7 | 148.4° | 116.8° |
| C13 | C14 | H17 | H18 | 121.2° | 122.5° |
| C17 | C15 | C16 | H7 | 108.7° | 108.0° |
| C15 | C17 | C16 | H8 | 109.5° | 107.6° |
| C15 | C17 | C16 | H9 | 109.5° | 107.6° |
| C17 | C15 | C16 | C8 | 116.5° | 114.1° |
| C15 | C17 | H8 | H9 | 144.7° | 145.4° |
| C17 | C15 | C16 | H16 | 108.1° | 107.8° |
| C17 | C15 | C14 | H17 | 63.2° | 153.6° |
| C17 | C15 | C14 | H18 | 176.0° | 30.9° |
| C15 | C16 | C8 | H16 | 136.0° | 139.7° |
| C15 | C16 | C8 | C13 | 15.8° | 22.6° |
| C15 | C16 | C8 | N1 | 108.6° | 142.3° |
| C15 | C16 | C8 | N2 | 141.4° | 97.6° |
| C16 | C15 | C14 | H17 | 128.7° | 142.3° |
| C16 | C15 | C14 | H18 | 110.5° | 95.0° |
| C7 | C6 | N1 | C8 | 173.8° | 178.5° |
| C7 | C6 | N1 | C5 | 2.0° | 1.8° |
| C6 | C7 | C2 | C1 | 179.9° | 179.3° |
| C6 | C7 | C2 | C3 | 1.2° | 1.9° |
| C6 | C7 | O | H15 | 0.1° | 0.0° |
| N1 | C6 | C7 | C2 | 0.2° | 0.3° |
| C6 | N1 | C8 | C16 | 57.5° | 56.4° |
| C6 | N1 | C8 | C13 | 63.0° | 59.9° |
| C6 | N1 | C8 | C5 | 175.9° | 179.7° |
| C6 | N1 | C8 | N2 | 179.7° | 178.7° |
| C6 | N1 | C5 | C3 | 2.4° | 1.2° |
| C6 | N1 | C5 | C9 | 175.5° | 178.7° |
| C7 | C2 | C1 | O4 | 1.4° | 11.9° |
| C7 | C2 | C1 | C3 | 178.6° | 178.9° |
| C7 | C2 | C1 | N | 179.3° | 168.0° |
| C7 | C2 | C3 | C5 | 0.9° | 2.5° |
| C7 | C2 | C3 | C4 | 176.8° | 176.8° |
| C2 | C7 | O | H15 | 179.4° | 179.9° |
| O4 | C1 | C2 | N | 179.2° | 179.9° |
| O4 | C1 | C2 | C3 | 177.2° | 167.0° |
| O4 | C1 | N | C18 | 5.0° | 7.6° |
| O4 | C1 | N | C | 156.7° | 172.5° |
| CL | C23 | C24 | C22 | 178.4° | 179.7° |
| CL | C23 | C24 | C19 | 177.6° | 180.0° |
| CL | C23 | C22 | F | 1.2° | 0.3° |
| CL | C23 | C22 | C21 | 178.2° | 179.7° |
| CL | C23 | C24 | H12 | 2.4° | 0.3° |
| C17 | C16 | C8 | H16 | 159.2° | 156.2° |
| C17 | C16 | C8 | C13 | 49.0° | 86.7° |
| C17 | C16 | C8 | N1 | 173.3° | 153.6° |
| C17 | C16 | C8 | N2 | 76.6° | 33.5° |
| C16 | C17 | H8 | H9 | 144.7° | 145.4° |
| C16 | C8 | C13 | N1 | 123.3° | 120.0° |
| C16 | C8 | C13 | N2 | 129.0° | 120.5° |
| C16 | C8 | N1 | N2 | 122.8° | 122.3° |
| C16 | C8 | N1 | C5 | 126.5° | 123.3° |
| C16 | C8 | N2 | C9 | 116.0° | 122.7° |
| C16 | C8 | N2 | C10 | 67.2° | 57.3° |
| C16 | C8 | C13 | H5 | 98.3° | 81.3° |
| C16 | C8 | C13 | H6 | 140.6° | 155.6° |
| C8 | C16 | C15 | H7 | 134.8° | 138.0° |
| C8 | C16 | C17 | H8 | 157.6° | 159.3° |
| C8 | C16 | C17 | H9 | 16.5° | 14.6° |
| C13 | C8 | N1 | N2 | 116.7° | 121.4° |
| C13 | C8 | N1 | C5 | 112.9° | 120.4° |
| C13 | C8 | N2 | C9 | 120.8° | 120.6° |
| C13 | C8 | N2 | C10 | 56.0° | 59.3° |
| C8 | C13 | H5 | H6 | 121.6° | 123.2° |
| C13 | C8 | C16 | H16 | 151.8° | 117.1° |
| C8 | C13 | C14 | H17 | 138.3° | 155.9° |
| C8 | C13 | C14 | H18 | 100.9° | 81.5° |
| C8 | N1 | C5 | C3 | 173.9° | 179.0° |
| C8 | N1 | C5 | C9 | 8.2° | 1.0° |
| N1 | C8 | N2 | C9 | 2.5° | 0.6° |
| N1 | C8 | N2 | C10 | 174.2° | 179.4° |
| N1 | C8 | C13 | H5 | 138.4° | 38.7° |
| N1 | C8 | C13 | H6 | 17.3° | 84.5° |
| N1 | C8 | C16 | H16 | 27.5° | 2.6° |
| N1 | C5 | C3 | C2 | 0.8° | 1.0° |
| C5 | N1 | C8 | N2 | 3.8° | 1.0° |
| N1 | C5 | C3 | C9 | 177.4° | 180.0° |
| N1 | C5 | C3 | C4 | 178.5° | 178.4° |
| N1 | C5 | C9 | N2 | 9.1° | 0.7° |
| N1 | C5 | C9 | O2 | 172.7° | 179.3° |
| C1 | C2 | C3 | C5 | 179.7° | 178.6° |
| C2 | C1 | N | C18 | 174.2° | 172.5° |
| C2 | C1 | N | C | 24.0° | 7.4° |
| C1 | C2 | C3 | C4 | 1.9° | 2.1° |
| N | C1 | C2 | C3 | 2.0° | 13.1° |
| C1 | N | C18 | C | 162.7° | 179.9° |
| C1 | N | C18 | C19 | 100.1° | 90.0° |
| C1 | N | C | C4 | 51.9° | 40.3° |
| C1 | N | C18 | H13 | 20.6° | 149.9° |
| C1 | N | C18 | H14 | 139.3° | 29.9° |
| C1 | N | C | H24 | 68.3° | 160.7° |
| C1 | N | C | H25 | 172.1° | 80.2° |
| C2 | C3 | C5 | C4 | 177.7° | 179.4° |
| C2 | C3 | C5 | C9 | 176.6° | 179.0° |
| C2 | C3 | C4 | C | 28.1° | 33.7° |
| C2 | C3 | C4 | H1 | 92.0° | 86.4° |
| C2 | C3 | C4 | H2 | 148.1° | 153.8° |
| C8 | N2 | C9 | C5 | 7.5° | 0.0° |
| C8 | N2 | C9 | C10 | 176.7° | 179.9° |
| C8 | N2 | C9 | O2 | 174.2° | 180.0° |
| C8 | N2 | C10 | C11 | 114.1° | 116.6° |
| C8 | N2 | C10 | H3 | 6.6° | 123.3° |
| C8 | N2 | C10 | H4 | 125.1° | 3.4° |
| N2 | C8 | C13 | H5 | 30.7° | 158.2° |
| N2 | C8 | C13 | H6 | 90.4° | 35.0° |
| N2 | C8 | C16 | H16 | 82.6° | 122.7° |
| C23 | C24 | C19 | H12 | 180.0° | 179.8° |
| C23 | C24 | C19 | C18 | 178.2° | 180.0° |
| C23 | C24 | C19 | C20 | 0.6° | 0.6° |
| C24 | C23 | C22 | F | 179.6° | 180.0° |
| C24 | C23 | C22 | C21 | 0.2° | 0.1° |
| C19 | C24 | C23 | C22 | 0.7° | 0.3° |
| C24 | C19 | C18 | N | 92.8° | 90.0° |
| C24 | C19 | C18 | C20 | 177.6° | 179.5° |
| C24 | C19 | C20 | C21 | 0.1° | 0.6° |
| C24 | C19 | C20 | H10 | 179.9° | 179.7° |
| C24 | C19 | C18 | H13 | 27.8° | 150.0° |
| C24 | C19 | C18 | H14 | 146.5° | 30.0° |
| C23 | C22 | F | C21 | 179.4° | 179.9° |
| C23 | C22 | C21 | C20 | 0.5° | 0.1° |
| C23 | C22 | C21 | H11 | 179.5° | 179.9° |
| C22 | C23 | C24 | H12 | 179.3° | 179.9° |
| C3 | C5 | C9 | N2 | 173.1° | 179.4° |
| C3 | C5 | C9 | O2 | 5.1° | 0.7° |
| C5 | C3 | C4 | C | 154.2° | 146.9° |
| C5 | C3 | C4 | H1 | 85.7° | 93.0° |
| C5 | C3 | C4 | H2 | 34.2° | 26.8° |
| C9 | C5 | C3 | C4 | 1.1° | 1.6° |
| C5 | C9 | N2 | O2 | 178.3° | 179.9° |
| C5 | C9 | N2 | C10 | 169.3° | 180.0° |
| N | C18 | C19 | H13 | 120.7° | 120.0° |
| N | C18 | C19 | H14 | 120.6° | 119.9° |
| N | C18 | C19 | C20 | 89.5° | 90.6° |
| C18 | N | C | C4 | 145.7° | 139.7° |
| N | C18 | H13 | H14 | 118.0° | 120.0° |
| C18 | N | C | H24 | 94.1° | 19.3° |
| C18 | N | C | H25 | 25.5° | 99.9° |
| N | C | C4 | C3 | 49.9° | 51.1° |
| C | N | C18 | C19 | 62.7° | 90.0° |
| N | C | C4 | H24 | 120.2° | 120.4° |
| N | C | C4 | H25 | 120.2° | 120.5° |
| N | C | C4 | H1 | 70.2° | 69.1° |
| N | C | C4 | H2 | 169.9° | 171.2° |
| C | N | C18 | H13 | 176.7° | 30.0° |
| C | N | C18 | H14 | 58.0° | 150.0° |
| N | C | H24 | H25 | 119.3° | 119.2° |
| C3 | C4 | C | H1 | 120.0° | 120.2° |
| C3 | C4 | C | H2 | 120.0° | 120.2° |
| C3 | C4 | H1 | H2 | 119.9° | 119.8° |
| C3 | C4 | C | H24 | 70.3° | 171.5° |
| C3 | C4 | C | H25 | 170.1° | 69.4° |
| C18 | C19 | C20 | C21 | 177.6° | 180.0° |
| C18 | C19 | C20 | H10 | 2.4° | 0.2° |
| C18 | C19 | C24 | H12 | 1.7° | 0.2° |
| C19 | C18 | H13 | H14 | 118.0° | 120.0° |
| C19 | C20 | C21 | C22 | 0.6° | 0.3° |
| C19 | C20 | C21 | H10 | 180.0° | 179.7° |
| C19 | C20 | C21 | H11 | 179.3° | 179.8° |
| C20 | C19 | C24 | H12 | 179.4° | 179.7° |
| C20 | C19 | C18 | H13 | 149.8° | 29.5° |
| C20 | C19 | C18 | H14 | 31.1° | 149.5° |
| C9 | N2 | C10 | C11 | 69.3° | 63.3° |
| C9 | N2 | C10 | H3 | 169.9° | 56.7° |
| C9 | N2 | C10 | H4 | 51.5° | 176.7° |
| C10 | N2 | C9 | O2 | 9.1° | 0.1° |
| N2 | C10 | C11 | H3 | 120.8° | 120.0° |
| N2 | C10 | C11 | H4 | 120.8° | 120.0° |
| N2 | C10 | C11 | O3 | 27.0° | 65.0° |
| N2 | C10 | C11 | C12 | 149.2° | 175.0° |
| N2 | C10 | H3 | H4 | 117.6° | 119.9° |
| N2 | C10 | C11 | H19 | 92.3° | 55.0° |
| F | C22 | C21 | C20 | 178.9° | 180.0° |
| F | C22 | C21 | H11 | 1.1° | 0.1° |
| C22 | C21 | C20 | H11 | 180.0° | 179.8° |
| C22 | C21 | C20 | H10 | 179.3° | 179.9° |
| C | C4 | H1 | H2 | 119.9° | 119.6° |
| C4 | C | H24 | H25 | 119.3° | 119.2° |
| C10 | C11 | O3 | C12 | 122.6° | 120.1° |
| C10 | C11 | O3 | H19 | 118.3° | 120.0° |
| C10 | C11 | C12 | H19 | 118.1° | 120.0° |
| C11 | C10 | H3 | H4 | 117.6° | 120.0° |
| C10 | C11 | O3 | H20 | 180.0° | 60.1° |
| C10 | C11 | C12 | H21 | 180.0° | 60.0° |
| C10 | C11 | C12 | H22 | 60.0° | 180.0° |
| C10 | C11 | C12 | H23 | 60.0° | 60.0° |
| O3 | C11 | C12 | H19 | 119.7° | 119.9° |
| O3 | C11 | C10 | H3 | 93.8° | 55.1° |
| O3 | C11 | C10 | H4 | 147.7° | 175.0° |
| O3 | C11 | C12 | H21 | 57.8° | 180.0° |
| O3 | C11 | C12 | H22 | 62.2° | 60.0° |
| O3 | C11 | C12 | H23 | 177.8° | 60.1° |
| C12 | C11 | C10 | H3 | 28.5° | 65.0° |
| C12 | C11 | C10 | H4 | 90.0° | 55.0° |
| C12 | C11 | O3 | H20 | 57.4° | 60.0° |
| C11 | C12 | H21 | H22 | 120.0° | 120.0° |
| C11 | C12 | H21 | H23 | 120.0° | 119.9° |
| C11 | C12 | H22 | H23 | 120.0° | 120.0° |
| H1 | C4 | C | H24 | 169.6° | 51.4° |
| H1 | C4 | C | H25 | 50.1° | 170.5° |
| H2 | C4 | C | H24 | 49.7° | 68.3° |
| H2 | C4 | C | H25 | 69.9° | 50.8° |
| H3 | C10 | C11 | H19 | 147.0° | 175.0° |
| H4 | C10 | C11 | H19 | 28.5° | 65.0° |
| H5 | C13 | C14 | H17 | 18.9° | 37.6° |
| H5 | C13 | C14 | H18 | 139.7° | 160.2° |
| H6 | C13 | C14 | H17 | 102.3° | 85.7° |
| H6 | C13 | C14 | H18 | 18.5° | 36.9° |
| H7 | C15 | C17 | H8 | 0.9° | 3.7° |
| H7 | C15 | C17 | H9 | 142.0° | 141.1° |
| H7 | C15 | C16 | H16 | 0.6° | 0.1° |
| H7 | C15 | C14 | H17 | 92.0° | 1.9° |
| H7 | C15 | C14 | H18 | 28.8° | 124.6° |
| H8 | C17 | C16 | H16 | 1.5° | 3.4° |
| H9 | C17 | C16 | H16 | 142.5° | 141.4° |
| H10 | C20 | C21 | H11 | 0.7° | 0.1° |
| H19 | C11 | O3 | H20 | 61.7° | 179.9° |
| H19 | C11 | C12 | H21 | 61.9° | 60.0° |
| H19 | C11 | C12 | H22 | 178.1° | 60.0° |
| H19 | C11 | C12 | H23 | 58.1° | 180.0° |
| H21 | C12 | H22 | H23 | 120.0° | 120.0° |
