FXV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.40Å | 1.43Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.43Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.10Å | |
| C2 | C3 | sing | 1.40Å | 1.44Å | Aromatic |
| C2 | C11 | sing | 1.48Å | 1.50Å | Aromatic |
| C3 | C4 | doub | 1.38Å | 1.43Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.10Å | |
| C4 | N1 | sing | 1.32Å | 1.37Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.10Å | |
| N1 | C6 | doub | 1.32Å | 1.39Å | Aromatic |
| N1 | O1 | sing | 1.42Å | 1.36Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C7 | C8 | doub | 1.40Å | 1.46Å | Aromatic |
| C7 | C12 | sing | 1.38Å | 1.44Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.10Å | |
| C8 | C9 | sing | 1.40Å | 1.44Å | Aromatic |
| C8 | C13 | sing | 1.48Å | 1.46Å | |
| C9 | C10 | doub | 1.38Å | 1.43Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.10Å | |
| C10 | C11 | sing | 1.39Å | 1.43Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.10Å | |
| C11 | C12 | doub | 1.40Å | 1.44Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.10Å | |
| C13 | N14 | sing | 1.35Å | 1.35Å | |
| C13 | O33 | doub | 1.21Å | 1.25Å | |
| N14 | C15 | sing | 1.47Å | 1.44Å | |
| N14 | H14 | sing | 0.97Å | 1.02Å | |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | C17 | sing | 1.53Å | 1.57Å | |
| C15 | H15 | sing | 1.09Å | 1.12Å | |
| C16 | H161 | sing | 1.09Å | 1.11Å | |
| C16 | H162 | sing | 1.09Å | 1.11Å | |
| C16 | H163 | sing | 1.09Å | 1.12Å | |
| C17 | C18 | sing | 1.51Å | 1.54Å | |
| C17 | C20 | sing | 1.53Å | 1.60Å | |
| C17 | H17 | sing | 1.09Å | 1.11Å | |
| C18 | O19 | sing | 1.34Å | 1.36Å | |
| C18 | O32 | doub | 1.21Å | 1.18Å | |
| O19 | C34 | sing | 1.45Å | 1.43Å | |
| C20 | C28 | sing | 1.51Å | 1.54Å | |
| C20 | H201 | sing | 1.09Å | 1.12Å | |
| C20 | H202 | sing | 1.09Å | 1.12Å | |
| C23 | C24 | doub | 1.40Å | 1.46Å | Aromatic |
| C23 | C28 | sing | 1.38Å | 1.46Å | Aromatic |
| C23 | H23 | sing | 1.08Å | 1.10Å | |
| C24 | C25 | sing | 1.39Å | 1.45Å | Aromatic |
| C24 | C29 | sing | 1.48Å | 1.46Å | |
| C25 | C26 | doub | 1.38Å | 1.43Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.10Å | |
| C26 | C27 | sing | 1.38Å | 1.44Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.10Å | |
| C27 | C28 | doub | 1.38Å | 1.44Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.10Å | |
| C29 | N30 | sing | 1.33Å | 1.34Å | |
| C29 | N31 | doub | 1.33Å | 1.34Å | |
| N30 | H301 | sing | 0.97Å | 1.02Å | |
| N30 | H302 | sing | 0.97Å | 1.02Å | |
| N31 | H311 | sing | 0.97Å | 1.02Å | |
| N31 | H312 | sing | 0.97Å | 1.02Å | |
| C34 | H341 | sing | 1.09Å | 1.12Å | |
| C34 | H342 | sing | 1.09Å | 1.12Å | |
| C34 | H343 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 118.6° | 119.0° |
| C2 | C1 | H1 | 121.0° | 120.5° |
| C1 | C2 | C3 | 117.9° | 118.2° |
| C1 | C2 | C11 | 120.7° | 120.9° |
| C6 | C1 | H1 | 120.5° | 120.5° |
| C1 | C6 | N1 | 123.1° | 120.9° |
| C1 | C6 | H6 | 119.7° | 119.6° |
| C3 | C2 | C11 | 121.4° | 120.9° |
| C2 | C3 | C4 | 120.2° | 119.1° |
| C2 | C3 | H3 | 120.2° | 120.5° |
| C2 | C11 | C10 | 121.2° | 120.0° |
| C2 | C11 | C12 | 121.1° | 120.0° |
| C4 | C3 | H3 | 119.6° | 120.5° |
| C3 | C4 | N1 | 121.3° | 120.9° |
| C3 | C4 | H4 | 121.5° | 119.5° |
| N1 | C4 | H4 | 117.1° | 119.6° |
| C4 | N1 | C6 | 118.9° | 122.0° |
| C4 | N1 | O1 | 121.4° | 119.0° |
| C6 | N1 | O1 | 119.7° | 119.0° |
| N1 | C6 | H6 | 117.2° | 119.5° |
| C8 | C7 | C12 | 119.3° | 119.9° |
| C8 | C7 | H7 | 121.2° | 120.1° |
| C7 | C8 | C9 | 118.1° | 120.0° |
| C7 | C8 | C13 | 123.8° | 120.0° |
| C12 | C7 | H7 | 119.5° | 120.0° |
| C7 | C12 | C11 | 122.4° | 120.1° |
| C7 | C12 | H12 | 118.7° | 120.0° |
| C9 | C8 | C13 | 118.1° | 120.0° |
| C8 | C9 | C10 | 121.4° | 120.0° |
| C8 | C9 | H9 | 119.8° | 120.0° |
| C8 | C13 | N14 | 114.6° | 120.0° |
| C8 | C13 | O33 | 122.8° | 120.0° |
| C10 | C9 | H9 | 118.8° | 120.0° |
| C9 | C10 | C11 | 121.1° | 120.0° |
| C9 | C10 | H10 | 119.2° | 120.0° |
| C11 | C10 | H10 | 119.7° | 120.0° |
| C10 | C11 | C12 | 117.7° | 120.0° |
| C11 | C12 | H12 | 118.9° | 120.0° |
| N14 | C13 | O33 | 122.6° | 120.1° |
| C13 | N14 | C15 | 123.2° | 119.9° |
| C13 | N14 | H14 | 114.8° | 120.0° |
| C15 | N14 | H14 | 121.9° | 120.0° |
| N14 | C15 | C16 | 107.6° | 109.5° |
| N14 | C15 | C17 | 108.3° | 109.5° |
| N14 | C15 | H15 | 113.3° | 109.5° |
| C16 | C15 | C17 | 114.4° | 109.5° |
| C16 | C15 | H15 | 107.1° | 109.5° |
| C15 | C16 | H161 | 112.9° | 109.4° |
| C15 | C16 | H162 | 107.6° | 109.5° |
| C15 | C16 | H163 | 112.9° | 109.5° |
| C17 | C15 | H15 | 106.2° | 109.4° |
| C15 | C17 | C18 | 109.6° | 109.5° |
| C15 | C17 | C20 | 113.7° | 109.5° |
| C15 | C17 | H17 | 107.0° | 109.5° |
| H161 | C16 | H162 | 112.9° | 109.5° |
| H161 | C16 | H163 | 97.5° | 109.5° |
| H162 | C16 | H163 | 112.9° | 109.5° |
| C18 | C17 | C20 | 111.0° | 109.5° |
| C18 | C17 | H17 | 109.9° | 109.4° |
| C17 | C18 | O19 | 111.6° | 120.0° |
| C17 | C18 | O32 | 123.8° | 120.0° |
| C20 | C17 | H17 | 105.4° | 109.5° |
| C17 | C20 | C28 | 116.2° | 109.5° |
| C17 | C20 | H201 | 109.8° | 109.4° |
| C17 | C20 | H202 | 109.8° | 109.5° |
| O19 | C18 | O32 | 124.7° | 120.0° |
| C18 | O19 | C34 | 122.3° | 120.0° |
| O19 | C34 | H341 | 107.7° | 109.4° |
| O19 | C34 | H342 | 122.3° | 109.5° |
| O19 | C34 | H343 | 107.6° | 109.5° |
| C28 | C20 | H201 | 109.8° | 109.5° |
| C28 | C20 | H202 | 109.7° | 109.5° |
| C20 | C28 | C23 | 122.9° | 119.9° |
| C20 | C28 | C27 | 119.0° | 119.9° |
| H201 | C20 | H202 | 100.4° | 109.4° |
| C24 | C23 | C28 | 121.1° | 119.8° |
| C24 | C23 | H23 | 119.4° | 120.1° |
| C23 | C24 | C25 | 118.5° | 119.7° |
| C23 | C24 | C29 | 121.4° | 120.2° |
| C28 | C23 | H23 | 119.5° | 120.1° |
| C23 | C28 | C27 | 118.1° | 120.2° |
| C25 | C24 | C29 | 120.1° | 120.1° |
| C24 | C25 | C26 | 120.7° | 119.8° |
| C24 | C25 | H25 | 120.4° | 120.1° |
| C24 | C29 | N30 | 121.7° | 120.0° |
| C24 | C29 | N31 | 119.2° | 120.0° |
| C26 | C25 | H25 | 118.9° | 120.0° |
| C25 | C26 | C27 | 120.4° | 120.1° |
| C25 | C26 | H26 | 119.5° | 119.9° |
| C27 | C26 | H26 | 120.1° | 120.0° |
| C26 | C27 | C28 | 121.2° | 120.3° |
| C26 | C27 | H27 | 119.2° | 119.8° |
| C28 | C27 | H27 | 119.5° | 119.9° |
| N30 | C29 | N31 | 119.2° | 120.0° |
| C29 | N30 | H301 | 107.8° | 120.0° |
| C29 | N30 | H302 | 121.7° | 120.0° |
| C29 | N31 | H311 | 119.2° | 120.0° |
| C29 | N31 | H312 | 119.2° | 120.1° |
| H301 | N30 | H302 | 107.9° | 120.0° |
| H311 | N31 | H312 | 121.7° | 119.9° |
| H341 | C34 | H342 | 107.6° | 109.5° |
| H341 | C34 | H343 | 102.2° | 109.5° |
| H342 | C34 | H343 | 107.6° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.6° |
| C1 | C2 | C3 | C11 | 179.5° | 179.8° |
| C1 | C2 | C3 | C4 | 0.1° | 0.2° |
| C1 | C2 | C3 | H3 | 179.9° | 179.7° |
| C2 | C1 | C6 | N1 | 0.1° | 0.5° |
| C2 | C1 | C6 | H6 | 180.0° | 179.7° |
| C1 | C2 | C11 | C10 | 36.8° | 40.0° |
| C1 | C2 | C11 | C12 | 142.6° | 140.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.5° |
| C6 | C1 | C2 | C11 | 179.6° | 179.7° |
| C1 | C6 | N1 | C4 | 0.0° | 0.2° |
| C1 | C6 | N1 | H6 | 180.0° | 179.8° |
| C1 | C6 | N1 | O1 | 180.0° | 179.7° |
| H1 | C1 | C2 | C3 | 179.9° | 180.0° |
| H1 | C1 | C2 | C11 | 0.4° | 0.2° |
| H1 | C1 | C6 | N1 | 179.9° | 179.9° |
| H1 | C1 | C6 | H6 | 0.0° | 0.1° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | N1 | 0.0° | 0.1° |
| C2 | C3 | C4 | H4 | 179.9° | 180.0° |
| C3 | C2 | C11 | C10 | 143.8° | 140.2° |
| C3 | C2 | C11 | C12 | 36.9° | 39.8° |
| C11 | C2 | C3 | C4 | 179.6° | 180.0° |
| C11 | C2 | C3 | H3 | 0.4° | 0.1° |
| C2 | C11 | C12 | C7 | 179.2° | 179.7° |
| C2 | C11 | C10 | C9 | 179.1° | 180.0° |
| C2 | C11 | C10 | C12 | 179.3° | 180.0° |
| C2 | C11 | C10 | H10 | 0.9° | 0.1° |
| C2 | C11 | C12 | H12 | 0.8° | 0.0° |
| C3 | C4 | N1 | H4 | 180.0° | 179.9° |
| C3 | C4 | N1 | C6 | 0.0° | 0.1° |
| C3 | C4 | N1 | O1 | 180.0° | 180.0° |
| H3 | C3 | C4 | N1 | 179.9° | 180.0° |
| H3 | C3 | C4 | H4 | 0.1° | 0.1° |
| C4 | N1 | C6 | O1 | 180.0° | 180.0° |
| C4 | N1 | C6 | H6 | 180.0° | 180.0° |
| H4 | C4 | N1 | C6 | 180.0° | 179.9° |
| H4 | C4 | N1 | O1 | 0.0° | 0.1° |
| O1 | N1 | C6 | H6 | 0.0° | 0.1° |
| C8 | C7 | C12 | H7 | 180.0° | 179.4° |
| C7 | C8 | C9 | C13 | 179.2° | 179.7° |
| C7 | C8 | C9 | C10 | 0.1° | 0.3° |
| C7 | C8 | C9 | H9 | 179.9° | 179.7° |
| C8 | C7 | C12 | C11 | 0.1° | 0.6° |
| C8 | C7 | C12 | H12 | 179.9° | 179.7° |
| C7 | C8 | C13 | N14 | 20.9° | 0.3° |
| C7 | C8 | C13 | O33 | 160.2° | 179.7° |
| C12 | C7 | C8 | C9 | 0.2° | 0.6° |
| C12 | C7 | C8 | C13 | 179.0° | 179.7° |
| C7 | C12 | C11 | C10 | 0.1° | 0.3° |
| C7 | C12 | C11 | H12 | 180.0° | 179.7° |
| H7 | C7 | C8 | C9 | 179.8° | 180.0° |
| H7 | C7 | C8 | C13 | 1.0° | 0.3° |
| H7 | C7 | C12 | C11 | 179.9° | 180.0° |
| H7 | C7 | C12 | H12 | 0.1° | 0.3° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | C11 | 0.1° | 0.0° |
| C8 | C9 | C10 | H10 | 179.8° | 179.9° |
| C9 | C8 | C13 | N14 | 158.2° | 180.0° |
| C9 | C8 | C13 | O33 | 20.7° | 0.0° |
| C13 | C8 | C9 | C10 | 179.1° | 180.0° |
| C13 | C8 | C9 | H9 | 0.9° | 0.0° |
| C8 | C13 | N14 | O33 | 178.9° | 180.0° |
| C8 | C13 | N14 | C15 | 177.9° | 180.0° |
| C8 | C13 | N14 | H14 | 2.1° | 0.0° |
| C9 | C10 | C11 | H10 | 180.0° | 179.9° |
| C9 | C10 | C11 | C12 | 0.2° | 0.0° |
| H9 | C9 | C10 | C11 | 179.9° | 180.0° |
| H9 | C9 | C10 | H10 | 0.1° | 0.1° |
| C10 | C11 | C12 | H12 | 179.9° | 180.0° |
| H10 | C10 | C11 | C12 | 179.7° | 179.9° |
| C13 | N14 | C15 | H14 | 180.0° | 179.9° |
| C13 | N14 | C15 | C16 | 107.9° | 85.0° |
| C13 | N14 | C15 | C17 | 127.9° | 155.0° |
| C13 | N14 | C15 | H15 | 10.2° | 35.0° |
| O33 | C13 | N14 | C15 | 1.0° | 0.0° |
| O33 | C13 | N14 | H14 | 179.0° | 180.0° |
| N14 | C15 | C16 | C17 | 120.4° | 120.0° |
| N14 | C15 | C16 | H15 | 122.1° | 120.0° |
| N14 | C15 | C17 | H15 | 122.1° | 120.0° |
| N14 | C15 | C16 | H161 | 54.7° | 60.0° |
| N14 | C15 | C16 | H162 | 180.0° | 180.0° |
| N14 | C15 | C16 | H163 | 54.8° | 60.0° |
| N14 | C15 | C17 | C18 | 179.5° | 60.0° |
| N14 | C15 | C17 | C20 | 54.6° | 180.0° |
| N14 | C15 | C17 | H17 | 61.4° | 60.0° |
| H14 | N14 | C15 | C16 | 72.1° | 94.9° |
| H14 | N14 | C15 | C17 | 52.1° | 25.1° |
| H14 | N14 | C15 | H15 | 169.7° | 145.0° |
| C16 | C15 | C17 | H15 | 117.9° | 120.0° |
| C15 | C16 | H161 | H162 | 122.3° | 120.0° |
| C15 | C16 | H161 | H163 | 118.8° | 120.0° |
| C15 | C16 | H162 | H163 | 125.3° | 120.0° |
| C16 | C15 | C17 | C18 | 59.5° | 180.0° |
| C16 | C15 | C17 | C20 | 65.4° | 60.0° |
| C16 | C15 | C17 | H17 | 178.6° | 60.1° |
| C17 | C15 | C16 | H161 | 175.1° | 180.0° |
| C17 | C15 | C16 | H162 | 59.6° | 60.0° |
| C17 | C15 | C16 | H163 | 65.7° | 60.0° |
| C15 | C17 | C18 | C20 | 126.5° | 120.0° |
| C15 | C17 | C18 | H17 | 117.3° | 120.0° |
| C15 | C17 | C20 | H17 | 116.9° | 120.0° |
| C15 | C17 | C18 | O19 | 52.1° | 60.0° |
| C15 | C17 | C18 | O32 | 127.2° | 120.0° |
| C15 | C17 | C20 | C28 | 159.9° | 175.0° |
| C15 | C17 | C20 | H201 | 74.8° | 55.0° |
| C15 | C17 | C20 | H202 | 34.7° | 65.0° |
| H15 | C15 | C16 | H161 | 67.4° | 60.0° |
| H15 | C15 | C16 | H162 | 57.9° | 60.0° |
| H15 | C15 | C16 | H163 | 176.9° | 180.0° |
| H15 | C15 | C17 | C18 | 58.4° | 60.0° |
| H15 | C15 | C17 | C20 | 176.7° | 60.0° |
| H15 | C15 | C17 | H17 | 60.7° | 179.9° |
| H161 | C16 | H162 | H163 | 109.5° | 120.0° |
| C18 | C17 | C20 | H17 | 119.0° | 120.0° |
| C17 | C18 | O19 | O32 | 179.3° | 180.0° |
| C17 | C18 | O19 | C34 | 179.6° | 180.0° |
| C18 | C17 | C20 | C28 | 75.9° | 65.0° |
| C18 | C17 | C20 | H201 | 49.3° | 175.0° |
| C18 | C17 | C20 | H202 | 158.8° | 55.0° |
| C20 | C17 | C18 | O19 | 178.6° | 180.0° |
| C20 | C17 | C18 | O32 | 0.7° | 0.0° |
| C17 | C20 | C28 | H201 | 125.3° | 120.0° |
| C17 | C20 | C28 | H202 | 125.3° | 120.0° |
| C17 | C20 | H201 | H202 | 115.6° | 120.0° |
| C17 | C20 | C28 | C23 | 31.3° | 90.3° |
| C17 | C20 | C28 | C27 | 148.3° | 90.0° |
| H17 | C17 | C18 | O19 | 65.1° | 60.0° |
| H17 | C17 | C18 | O32 | 115.5° | 120.0° |
| H17 | C17 | C20 | C28 | 43.0° | 54.9° |
| H17 | C17 | C20 | H201 | 168.3° | 65.1° |
| H17 | C17 | C20 | H202 | 82.2° | 175.0° |
| C18 | O19 | C34 | H341 | 54.7° | 180.0° |
| C18 | O19 | C34 | H342 | 180.0° | 60.1° |
| C18 | O19 | C34 | H343 | 54.7° | 60.0° |
| O32 | C18 | O19 | C34 | 0.3° | 0.0° |
| O19 | C34 | H341 | H342 | 133.6° | 120.0° |
| O19 | C34 | H341 | H343 | 113.2° | 120.0° |
| O19 | C34 | H342 | H343 | 125.3° | 120.0° |
| C28 | C20 | H201 | H202 | 115.5° | 120.0° |
| C20 | C28 | C23 | C24 | 179.8° | 179.8° |
| C20 | C28 | C23 | C27 | 179.6° | 179.7° |
| C20 | C28 | C23 | H23 | 0.2° | 0.3° |
| C20 | C28 | C27 | C26 | 179.8° | 180.0° |
| C20 | C28 | C27 | H27 | 0.2° | 0.1° |
| H201 | C20 | C28 | C23 | 156.6° | 149.7° |
| H201 | C20 | C28 | C27 | 23.0° | 30.0° |
| H202 | C20 | C28 | C23 | 94.0° | 29.7° |
| H202 | C20 | C28 | C27 | 86.4° | 149.9° |
| C24 | C23 | C28 | H23 | 180.0° | 179.5° |
| C23 | C24 | C25 | C29 | 179.9° | 179.8° |
| C23 | C24 | C25 | C26 | 0.1° | 0.2° |
| C23 | C24 | C25 | H25 | 179.9° | 179.8° |
| C24 | C23 | C28 | C27 | 0.2° | 0.6° |
| C23 | C24 | C29 | N30 | 156.5° | 179.8° |
| C23 | C24 | C29 | N31 | 23.8° | 0.2° |
| C28 | C23 | C24 | C25 | 0.1° | 0.5° |
| C28 | C23 | C24 | C29 | 180.0° | 179.7° |
| C23 | C28 | C27 | C26 | 0.2° | 0.3° |
| C23 | C28 | C27 | H27 | 179.8° | 179.8° |
| H23 | C23 | C24 | C25 | 179.9° | 180.0° |
| H23 | C23 | C24 | C29 | 0.0° | 0.2° |
| H23 | C23 | C28 | C27 | 179.8° | 180.0° |
| C24 | C25 | C26 | H25 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.2° | 0.0° |
| C24 | C25 | C26 | H26 | 179.8° | 180.0° |
| C25 | C24 | C29 | N30 | 23.6° | 0.0° |
| C25 | C24 | C29 | N31 | 156.1° | 180.0° |
| C29 | C24 | C25 | C26 | 180.0° | 179.9° |
| C29 | C24 | C25 | H25 | 0.0° | 0.1° |
| C24 | C29 | N30 | N31 | 179.7° | 180.0° |
| C24 | C29 | N30 | H301 | 54.8° | 179.9° |
| C24 | C29 | N30 | H302 | 180.0° | 0.0° |
| C24 | C29 | N31 | H311 | 180.0° | 0.0° |
| C24 | C29 | N31 | H312 | 0.3° | 180.0° |
| C25 | C26 | C27 | H26 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 0.2° | 0.0° |
| C25 | C26 | C27 | H27 | 179.8° | 179.9° |
| H25 | C25 | C26 | C27 | 179.8° | 180.0° |
| H25 | C25 | C26 | H26 | 0.1° | 0.0° |
| C26 | C27 | C28 | H27 | 180.0° | 179.9° |
| H26 | C26 | C27 | C28 | 179.8° | 180.0° |
| H26 | C26 | C27 | H27 | 0.2° | 0.1° |
| C29 | N30 | H301 | H302 | 133.1° | 179.9° |
| N30 | C29 | N31 | H311 | 0.3° | 180.0° |
| N30 | C29 | N31 | H312 | 180.0° | 0.0° |
| N31 | C29 | N30 | H301 | 125.0° | 0.0° |
| N31 | C29 | N30 | H302 | 0.3° | 179.9° |
| C29 | N31 | H311 | H312 | 179.7° | 180.0° |
| H341 | C34 | H342 | H343 | 109.5° | 120.0° |
