4RT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C7 | sing | 1.35Å | 1.35Å | |
| O1 | C6 | doub | 1.22Å | 1.23Å | |
| C13 | C12 | sing | 1.54Å | 1.54Å | |
| C13 | C14 | sing | 1.54Å | 1.48Å | |
| C13 | C16 | sing | 1.53Å | 1.53Å | |
| C12 | C11 | sing | 1.55Å | 1.54Å | |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| C15 | O3 | sing | 1.43Å | 1.42Å | |
| C6 | C7 | sing | 1.47Å | 1.45Å | |
| C6 | N1 | sing | 1.35Å | 1.39Å | |
| C7 | C2 | doub | 1.38Å | 1.43Å | |
| O4 | C1 | doub | 1.22Å | 1.23Å | |
| C14 | C16 | sing | 1.53Å | 1.48Å | |
| C14 | C8 | sing | 1.54Å | 1.57Å | |
| CL | C22 | sing | 1.74Å | 1.73Å | |
| N1 | C8 | sing | 1.46Å | 1.49Å | |
| N1 | C5 | sing | 1.38Å | 1.39Å | |
| C11 | C8 | sing | 1.54Å | 1.54Å | |
| C2 | C1 | sing | 1.48Å | 1.46Å | |
| C2 | C3 | sing | 1.41Å | 1.44Å | |
| C1 | N | sing | 1.35Å | 1.36Å | |
| C8 | N2 | sing | 1.46Å | 1.49Å | |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C18 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C5 | C3 | doub | 1.36Å | 1.39Å | |
| C5 | C9 | sing | 1.48Å | 1.45Å | |
| C3 | C4 | sing | 1.51Å | 1.51Å | |
| N | C17 | sing | 1.46Å | 1.47Å | |
| N | C | sing | 1.46Å | 1.47Å | |
| C17 | C18 | sing | 1.51Å | 1.51Å | |
| N2 | C9 | sing | 1.35Å | 1.35Å | |
| N2 | C10 | sing | 1.46Å | 1.47Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | F | sing | 1.35Å | 1.36Å | |
| C21 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | O2 | doub | 1.22Å | 1.23Å | |
| C | C4 | sing | 1.53Å | 1.51Å | |
| C19 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| 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 | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C17 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.08Å | 1.08Å | |
| C23 | H13 | sing | 1.08Å | 1.08Å | |
| O | H14 | sing | 0.97Å | 0.95Å | |
| O3 | H15 | sing | 0.97Å | 0.95Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C11 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C | H22 | sing | 1.09Å | 1.10Å | |
| C | H23 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C7 | C6 | 113.1° | 121.0° |
| O | C7 | C2 | 121.0° | 120.9° |
| C7 | O | H14 | 109.5° | 114.0° |
| O1 | C6 | C7 | 121.7° | 120.2° |
| O1 | C6 | N1 | 122.6° | 120.2° |
| C12 | C13 | C14 | 109.3° | 106.5° |
| C12 | C13 | C16 | 117.9° | 118.1° |
| C13 | C12 | C11 | 104.3° | 104.2° |
| C12 | C13 | H6 | 118.4° | 117.4° |
| C13 | C12 | H18 | 110.8° | 110.5° |
| C13 | C12 | H19 | 110.8° | 110.5° |
| C14 | C13 | C16 | 58.9° | 59.8° |
| C13 | C14 | C15 | 114.7° | 121.0° |
| C13 | C14 | C16 | 62.0° | 59.8° |
| C13 | C14 | C8 | 107.0° | 106.4° |
| C14 | C13 | H6 | 119.5° | 121.4° |
| C13 | C16 | C14 | 59.1° | 60.4° |
| C16 | C13 | H6 | 118.6° | 119.8° |
| C13 | C16 | H16 | 120.2° | 117.4° |
| C13 | C16 | H17 | 120.2° | 117.5° |
| C12 | C11 | C8 | 105.5° | 102.7° |
| C11 | C12 | H18 | 110.7° | 110.5° |
| C11 | C12 | H19 | 110.8° | 110.5° |
| C12 | C11 | H20 | 110.5° | 110.8° |
| C12 | C11 | H21 | 110.5° | 110.8° |
| C14 | C15 | O3 | 106.5° | 109.5° |
| C15 | C14 | C16 | 116.1° | 119.8° |
| C15 | C14 | C8 | 120.2° | 117.3° |
| C14 | C15 | H7 | 110.2° | 109.5° |
| C14 | C15 | H8 | 110.2° | 109.5° |
| O3 | C15 | H7 | 110.2° | 109.5° |
| O3 | C15 | H8 | 110.2° | 109.5° |
| C15 | O3 | H15 | 109.5° | 114.0° |
| C7 | C6 | N1 | 115.7° | 119.6° |
| C6 | C7 | C2 | 125.8° | 118.1° |
| C6 | N1 | C8 | 127.7° | 131.9° |
| C6 | N1 | C5 | 119.5° | 121.2° |
| C7 | C2 | C1 | 122.6° | 121.4° |
| C7 | C2 | C3 | 114.9° | 119.6° |
| O4 | C1 | C2 | 122.4° | 120.4° |
| O4 | C1 | N | 122.6° | 120.4° |
| C16 | C14 | C8 | 120.8° | 118.7° |
| C14 | C16 | H16 | 120.1° | 117.4° |
| C14 | C16 | H17 | 120.1° | 117.5° |
| C14 | C8 | N1 | 118.8° | 111.1° |
| C14 | C8 | C11 | 103.2° | 105.0° |
| C14 | C8 | N2 | 112.8° | 111.3° |
| CL | C22 | C23 | 120.2° | 120.0° |
| CL | C22 | C21 | 120.0° | 120.0° |
| C8 | N1 | C5 | 112.7° | 106.9° |
| N1 | C8 | C11 | 112.4° | 110.8° |
| N1 | C8 | N2 | 97.6° | 107.7° |
| N1 | C5 | C3 | 125.4° | 120.9° |
| N1 | C5 | C9 | 106.1° | 108.3° |
| C11 | C8 | N2 | 112.5° | 111.0° |
| C8 | C11 | H20 | 110.4° | 110.8° |
| C8 | C11 | H21 | 110.5° | 110.8° |
| C1 | C2 | C3 | 122.5° | 119.1° |
| C2 | C1 | N | 115.0° | 119.2° |
| C2 | C3 | C5 | 118.7° | 120.6° |
| C2 | C3 | C4 | 119.3° | 119.0° |
| C1 | N | C17 | 119.6° | 119.4° |
| C1 | N | C | 122.3° | 121.2° |
| C8 | N2 | C9 | 113.1° | 107.7° |
| C8 | N2 | C10 | 124.0° | 126.2° |
| C22 | C23 | C18 | 120.3° | 120.0° |
| C23 | C22 | C21 | 119.9° | 120.0° |
| C22 | C23 | H13 | 119.9° | 120.0° |
| C23 | C18 | C17 | 120.5° | 120.0° |
| C23 | C18 | C19 | 118.6° | 120.1° |
| C18 | C23 | H13 | 119.9° | 120.0° |
| C22 | C21 | F | 119.2° | 120.1° |
| C22 | C21 | C20 | 121.3° | 119.9° |
| C3 | C5 | C9 | 128.5° | 130.7° |
| C5 | C3 | C4 | 121.8° | 120.4° |
| C5 | C9 | N2 | 106.8° | 109.3° |
| C5 | C9 | O2 | 130.1° | 125.3° |
| C3 | C4 | C | 110.1° | 110.0° |
| C3 | C4 | H1 | 109.3° | 109.4° |
| C3 | C4 | H2 | 109.3° | 109.4° |
| C17 | N | C | 116.0° | 119.4° |
| N | C17 | C18 | 113.3° | 109.5° |
| N | C17 | H9 | 108.5° | 109.4° |
| N | C17 | H10 | 108.5° | 109.5° |
| N | C | C4 | 112.3° | 111.1° |
| N | C | H22 | 108.8° | 109.1° |
| N | C | H23 | 108.7° | 109.2° |
| C17 | C18 | C19 | 120.9° | 119.9° |
| C18 | C17 | H9 | 108.5° | 109.5° |
| C18 | C17 | H10 | 108.5° | 109.5° |
| C9 | N2 | C10 | 122.9° | 126.1° |
| N2 | C9 | O2 | 123.1° | 125.4° |
| N2 | C10 | H3 | 109.5° | 109.4° |
| N2 | C10 | H4 | 109.5° | 109.5° |
| N2 | C10 | H5 | 109.5° | 109.5° |
| C18 | C19 | C20 | 121.1° | 120.0° |
| C18 | C19 | H12 | 119.4° | 120.0° |
| F | C21 | C20 | 119.5° | 120.0° |
| C21 | C20 | C19 | 118.9° | 120.0° |
| C21 | C20 | H11 | 120.5° | 120.0° |
| C | C4 | H1 | 109.3° | 109.4° |
| C | C4 | H2 | 109.3° | 109.3° |
| C4 | C | H22 | 108.7° | 109.1° |
| C4 | C | H23 | 108.8° | 109.1° |
| C19 | C20 | H11 | 120.6° | 120.0° |
| C20 | C19 | H12 | 119.5° | 120.0° |
| H1 | C4 | H2 | 109.4° | 109.4° |
| H3 | C10 | H4 | 109.4° | 109.5° |
| H3 | C10 | H5 | 109.5° | 109.4° |
| H4 | C10 | H5 | 109.5° | 109.6° |
| H7 | C15 | H8 | 109.5° | 109.5° |
| H9 | C17 | H10 | 109.5° | 109.5° |
| H16 | C16 | H17 | 109.5° | 115.6° |
| H18 | C12 | H19 | 109.5° | 110.5° |
| H20 | C11 | H21 | 109.5° | 110.8° |
| H22 | C | H23 | 109.5° | 109.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C7 | C6 | O1 | 0.8° | 0.3° |
| O | C7 | C6 | C2 | 179.9° | 179.9° |
| O | C7 | C6 | N1 | 179.8° | 179.7° |
| O | C7 | C2 | C1 | 1.2° | 0.6° |
| O | C7 | C2 | C3 | 179.7° | 178.3° |
| O1 | C6 | C7 | N1 | 179.4° | 180.0° |
| O1 | C6 | C7 | C2 | 179.1° | 179.8° |
| O1 | C6 | N1 | C8 | 2.3° | 1.2° |
| O1 | C6 | N1 | C5 | 179.6° | 178.3° |
| C12 | C13 | C14 | C16 | 111.6° | 113.4° |
| C12 | C13 | C14 | H6 | 140.9° | 138.1° |
| C12 | C13 | C16 | H6 | 154.2° | 155.3° |
| C13 | C12 | C11 | H18 | 119.2° | 118.7° |
| C13 | C12 | C11 | H19 | 119.2° | 118.7° |
| C12 | C13 | C14 | C15 | 140.7° | 138.0° |
| C12 | C13 | C14 | C8 | 4.8° | 0.7° |
| C13 | C12 | C11 | C8 | 30.1° | 37.3° |
| C12 | C13 | C16 | H16 | 12.5° | 14.0° |
| C12 | C13 | C16 | H17 | 154.1° | 158.8° |
| C13 | C12 | H18 | H19 | 122.4° | 122.6° |
| C13 | C12 | C11 | H20 | 149.5° | 155.6° |
| C13 | C12 | C11 | H21 | 89.3° | 81.1° |
| C14 | C13 | C16 | H6 | 109.1° | 111.2° |
| C14 | C13 | C12 | C11 | 15.5° | 23.6° |
| C13 | C14 | C15 | C16 | 69.5° | 70.6° |
| C13 | C14 | C15 | C8 | 129.6° | 132.9° |
| C13 | C14 | C15 | O3 | 177.5° | 65.4° |
| C13 | C14 | C16 | C8 | 93.9° | 93.1° |
| C13 | C14 | C8 | N1 | 101.9° | 142.6° |
| C13 | C14 | C8 | C11 | 23.1° | 22.7° |
| C13 | C14 | C8 | N2 | 144.8° | 97.4° |
| C13 | C14 | C15 | H7 | 63.0° | 54.6° |
| C13 | C14 | C15 | H8 | 58.0° | 174.6° |
| C14 | C13 | C16 | H16 | 109.2° | 107.6° |
| C14 | C13 | C16 | H17 | 109.2° | 107.6° |
| C14 | C13 | C12 | H18 | 103.6° | 142.3° |
| C14 | C13 | C12 | H19 | 134.7° | 95.1° |
| C16 | C13 | C12 | C11 | 48.8° | 87.7° |
| C13 | C16 | H16 | H17 | 145.3° | 145.5° |
| C16 | C13 | C12 | H18 | 167.9° | 153.6° |
| C16 | C13 | C12 | H19 | 70.4° | 31.0° |
| C12 | C11 | C8 | C14 | 32.7° | 37.1° |
| C12 | C11 | C8 | N1 | 96.4° | 157.1° |
| C12 | C11 | C8 | H20 | 119.4° | 118.3° |
| C12 | C11 | C8 | H21 | 119.4° | 118.3° |
| C12 | C11 | C8 | N2 | 154.6° | 83.2° |
| C11 | C12 | C13 | H6 | 156.9° | 116.4° |
| C11 | C12 | H18 | H19 | 122.4° | 122.6° |
| C12 | C11 | H20 | H21 | 121.8° | 123.3° |
| C14 | C15 | O3 | H7 | 119.5° | 120.0° |
| C14 | C15 | O3 | H8 | 119.5° | 120.0° |
| C15 | C14 | C16 | C8 | 160.7° | 156.2° |
| C15 | C14 | C8 | N1 | 31.0° | 3.4° |
| C15 | C14 | C8 | C11 | 156.1° | 116.4° |
| C15 | C14 | C8 | N2 | 82.2° | 123.4° |
| C15 | C14 | C13 | H6 | 0.2° | 0.1° |
| C14 | C15 | H7 | H8 | 121.4° | 120.0° |
| C14 | C15 | O3 | H15 | 180.0° | 180.0° |
| C15 | C14 | C16 | H16 | 145.4° | 141.7° |
| C15 | C14 | C16 | H17 | 3.9° | 3.1° |
| O3 | C15 | C14 | C16 | 113.0° | 5.1° |
| O3 | C15 | C14 | C8 | 47.9° | 161.6° |
| O3 | C15 | H7 | H8 | 121.4° | 120.0° |
| C7 | C6 | N1 | C8 | 177.1° | 178.8° |
| C7 | C6 | N1 | C5 | 0.1° | 1.7° |
| C6 | C7 | C2 | C1 | 178.7° | 179.3° |
| C6 | C7 | C2 | C3 | 0.5° | 1.8° |
| C6 | C7 | O | H14 | 0.4° | 0.1° |
| N1 | C6 | C7 | C2 | 0.3° | 0.2° |
| C6 | N1 | C8 | C14 | 50.7° | 58.9° |
| C6 | N1 | C8 | C5 | 177.4° | 179.6° |
| C6 | N1 | C8 | C11 | 69.8° | 57.4° |
| C6 | N1 | C8 | N2 | 172.0° | 179.0° |
| C6 | N1 | C5 | C3 | 0.5° | 1.1° |
| C6 | N1 | C5 | C9 | 177.8° | 179.1° |
| C7 | C2 | C1 | O4 | 0.2° | 12.0° |
| C7 | C2 | C1 | C3 | 179.1° | 178.9° |
| C7 | C2 | C1 | N | 179.5° | 168.0° |
| C7 | C2 | C3 | C5 | 0.2° | 2.4° |
| C7 | C2 | C3 | C4 | 176.1° | 176.8° |
| C2 | C7 | O | H14 | 179.5° | 180.0° |
| O4 | C1 | C2 | N | 179.6° | 179.9° |
| O4 | C1 | C2 | C3 | 179.3° | 167.0° |
| O4 | C1 | N | C17 | 5.7° | 7.5° |
| O4 | C1 | N | C | 157.2° | 172.5° |
| C16 | C14 | C8 | N1 | 169.0° | 153.3° |
| C16 | C14 | C8 | C11 | 43.9° | 86.8° |
| C16 | C14 | C8 | N2 | 77.7° | 33.3° |
| C16 | C14 | C15 | H7 | 6.5° | 125.1° |
| C16 | C14 | C15 | H8 | 127.5° | 114.9° |
| C14 | C16 | H16 | H17 | 145.2° | 145.5° |
| C14 | C8 | N1 | C11 | 120.5° | 116.3° |
| C14 | C8 | N1 | N2 | 121.3° | 122.1° |
| C14 | C8 | N1 | C5 | 131.9° | 121.5° |
| C14 | C8 | C11 | N2 | 121.8° | 120.3° |
| C14 | C8 | N2 | C9 | 144.6° | 121.7° |
| C14 | C8 | N2 | C10 | 36.8° | 58.4° |
| C8 | C14 | C13 | H6 | 136.1° | 137.4° |
| C8 | C14 | C15 | H7 | 167.4° | 78.4° |
| C8 | C14 | C15 | H8 | 71.6° | 41.6° |
| C8 | C14 | C16 | H16 | 15.4° | 14.4° |
| C8 | C14 | C16 | H17 | 156.9° | 159.3° |
| C14 | C8 | C11 | H20 | 152.1° | 155.4° |
| C14 | C8 | C11 | H21 | 86.7° | 81.2° |
| CL | C22 | C23 | C21 | 178.0° | 179.9° |
| CL | C22 | C23 | C18 | 176.9° | 179.7° |
| CL | C22 | C21 | F | 1.2° | 0.1° |
| CL | C22 | C21 | C20 | 177.9° | 179.9° |
| CL | C22 | C23 | H13 | 3.2° | 0.2° |
| N1 | C8 | C11 | N2 | 109.0° | 119.7° |
| C8 | N1 | C5 | C3 | 177.1° | 179.3° |
| C8 | N1 | C5 | C9 | 0.2° | 0.6° |
| N1 | C8 | N2 | C9 | 18.9° | 0.3° |
| N1 | C8 | N2 | C10 | 162.5° | 179.7° |
| N1 | C8 | C11 | H20 | 22.9° | 84.6° |
| N1 | C8 | C11 | H21 | 144.2° | 38.8° |
| C5 | N1 | C8 | C11 | 107.6° | 122.1° |
| N1 | C5 | C3 | C2 | 0.3° | 1.0° |
| C5 | N1 | C8 | N2 | 10.7° | 0.5° |
| N1 | C5 | C3 | C9 | 176.7° | 179.8° |
| N1 | C5 | C3 | C4 | 175.5° | 178.2° |
| N1 | C5 | C9 | N2 | 11.9° | 0.4° |
| N1 | C5 | C9 | O2 | 167.5° | 179.6° |
| C11 | C8 | N2 | C9 | 99.2° | 121.8° |
| C11 | C8 | N2 | C10 | 79.4° | 58.2° |
| C8 | C11 | C12 | H18 | 89.1° | 155.9° |
| C8 | C11 | C12 | H19 | 149.3° | 81.4° |
| C8 | C11 | H20 | H21 | 121.8° | 123.3° |
| C1 | C2 | C3 | C5 | 179.0° | 178.6° |
| C1 | C2 | C3 | C4 | 3.0° | 2.1° |
| C2 | C1 | N | C17 | 174.0° | 172.6° |
| C2 | C1 | N | C | 23.2° | 7.5° |
| C3 | C2 | C1 | N | 0.4° | 13.1° |
| C2 | C3 | C5 | C4 | 175.8° | 179.2° |
| C2 | C3 | C5 | C9 | 177.0° | 178.8° |
| C2 | C3 | C4 | C | 26.5° | 33.8° |
| C2 | C3 | C4 | H1 | 93.6° | 86.3° |
| C2 | C3 | C4 | H2 | 146.6° | 153.9° |
| C1 | N | C17 | C | 163.9° | 180.0° |
| C1 | N | C17 | C18 | 104.5° | 90.0° |
| C1 | N | C | C4 | 48.4° | 40.3° |
| C1 | N | C17 | H9 | 16.0° | 150.0° |
| C1 | N | C17 | H10 | 134.9° | 30.0° |
| C1 | N | C | H22 | 72.0° | 160.7° |
| C1 | N | C | H23 | 168.8° | 80.1° |
| C8 | N2 | C9 | C5 | 20.2° | 0.1° |
| C8 | N2 | C9 | C10 | 178.6° | 180.0° |
| C8 | N2 | C9 | O2 | 159.3° | 179.9° |
| C8 | N2 | C10 | H3 | 180.0° | 5.4° |
| C8 | N2 | C10 | H4 | 60.0° | 114.6° |
| C8 | N2 | C10 | H5 | 60.0° | 125.3° |
| N2 | C8 | C11 | H20 | 86.1° | 35.1° |
| N2 | C8 | C11 | H21 | 35.2° | 158.4° |
| C22 | C23 | C18 | H13 | 180.0° | 179.8° |
| C22 | C23 | C18 | C17 | 177.9° | 180.0° |
| C22 | C23 | C18 | C19 | 1.3° | 0.2° |
| C23 | C22 | C21 | F | 179.2° | 180.0° |
| C23 | C22 | C21 | C20 | 0.1° | 0.0° |
| C18 | C23 | C22 | C21 | 1.2° | 0.2° |
| C23 | C18 | C17 | N | 90.5° | 90.0° |
| C23 | C18 | C17 | C19 | 179.2° | 179.7° |
| C23 | C18 | C19 | C20 | 0.4° | 0.0° |
| C23 | C18 | C17 | H9 | 30.1° | 150.0° |
| C23 | C18 | C17 | H10 | 148.9° | 30.0° |
| C23 | C18 | C19 | H12 | 179.6° | 180.0° |
| C22 | C21 | F | C20 | 179.1° | 180.0° |
| C22 | C21 | C20 | C19 | 0.8° | 0.3° |
| C22 | C21 | C20 | H11 | 179.2° | 180.0° |
| C21 | C22 | C23 | H13 | 178.8° | 180.0° |
| C3 | C5 | C9 | N2 | 170.9° | 179.4° |
| C3 | C5 | C9 | O2 | 9.7° | 0.6° |
| C5 | C3 | C4 | C | 157.7° | 146.9° |
| C5 | C3 | C4 | H1 | 82.2° | 92.9° |
| C5 | C3 | C4 | H2 | 37.6° | 26.9° |
| C9 | C5 | C3 | C4 | 1.2° | 1.9° |
| C5 | C9 | N2 | O2 | 179.5° | 180.0° |
| C5 | C9 | N2 | C10 | 161.2° | 180.0° |
| C3 | C4 | C | N | 46.1° | 51.1° |
| C3 | C4 | C | H1 | 120.1° | 120.2° |
| C3 | C4 | C | H2 | 120.1° | 120.1° |
| C3 | C4 | H1 | H2 | 119.7° | 119.8° |
| C3 | C4 | C | H22 | 74.4° | 171.5° |
| C3 | C4 | C | H23 | 166.5° | 69.3° |
| N | C17 | C18 | H9 | 120.6° | 120.0° |
| N | C17 | C18 | H10 | 120.6° | 120.0° |
| N | C17 | C18 | C19 | 88.7° | 90.3° |
| C17 | N | C | C4 | 148.2° | 139.7° |
| N | C17 | H9 | H10 | 118.3° | 120.0° |
| C17 | N | C | H22 | 91.4° | 19.3° |
| C17 | N | C | H23 | 27.8° | 99.9° |
| C | N | C17 | C18 | 59.3° | 90.0° |
| N | C | C4 | H22 | 120.4° | 120.4° |
| N | C | C4 | H23 | 120.4° | 120.4° |
| N | C | C4 | H1 | 74.1° | 69.0° |
| N | C | C4 | H2 | 166.2° | 171.3° |
| C | N | C17 | H9 | 179.9° | 30.0° |
| C | N | C17 | H10 | 61.2° | 150.0° |
| N | C | H22 | H23 | 118.7° | 119.2° |
| C17 | C18 | C19 | C20 | 178.8° | 179.7° |
| C18 | C17 | H9 | H10 | 118.3° | 120.0° |
| C17 | C18 | C19 | H12 | 1.2° | 0.3° |
| C17 | C18 | C23 | H13 | 2.1° | 0.2° |
| C9 | N2 | C10 | H3 | 1.5° | 174.5° |
| C9 | N2 | C10 | H4 | 118.4° | 65.5° |
| C9 | N2 | C10 | H5 | 121.5° | 54.7° |
| C10 | N2 | C9 | O2 | 19.3° | 0.0° |
| N2 | C10 | H3 | H4 | 120.0° | 120.0° |
| N2 | C10 | H3 | H5 | 120.0° | 119.9° |
| N2 | C10 | H4 | H5 | 120.0° | 120.1° |
| C18 | C19 | C20 | C21 | 0.6° | 0.3° |
| C18 | C19 | C20 | H12 | 180.0° | 180.0° |
| C19 | C18 | C17 | H9 | 150.8° | 29.7° |
| C19 | C18 | C17 | H10 | 31.9° | 149.7° |
| C18 | C19 | C20 | H11 | 179.4° | 180.0° |
| C19 | C18 | C23 | H13 | 178.7° | 179.9° |
| F | C21 | C20 | C19 | 178.3° | 179.7° |
| F | C21 | C20 | H11 | 1.7° | 0.0° |
| C21 | C20 | C19 | H11 | 180.0° | 179.7° |
| C21 | C20 | C19 | H12 | 179.4° | 179.7° |
| C | C4 | H1 | H2 | 119.7° | 119.7° |
| C4 | C | H22 | H23 | 118.7° | 119.2° |
| H1 | C4 | C | H22 | 165.5° | 51.3° |
| H1 | C4 | C | H23 | 46.3° | 170.5° |
| H2 | C4 | C | H22 | 45.8° | 68.4° |
| H2 | C4 | C | H23 | 73.4° | 50.8° |
| H3 | C10 | H4 | H5 | 120.0° | 120.0° |
| H6 | C13 | C16 | H16 | 141.8° | 141.3° |
| H6 | C13 | C16 | H17 | 0.1° | 3.5° |
| H6 | C13 | C12 | H18 | 37.8° | 2.3° |
| H6 | C13 | C12 | H19 | 83.9° | 124.9° |
| H7 | C15 | O3 | H15 | 60.5° | 60.0° |
| H8 | C15 | O3 | H15 | 60.5° | 60.0° |
| H11 | C20 | C19 | H12 | 0.6° | 0.0° |
| H18 | C12 | C11 | H20 | 30.3° | 85.7° |
| H18 | C12 | C11 | H21 | 151.5° | 37.6° |
| H19 | C12 | C11 | H20 | 91.3° | 36.9° |
| H19 | C12 | C11 | H21 | 29.9° | 160.3° |
