FWH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C16 | doub | 1.34Å | 1.33Å | |
| C1 | C6 | doub | 1.36Å | 1.37Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.42Å | Aromatic |
| C2 | C3 | doub | 1.36Å | 1.37Å | Aromatic |
| C16 | C9 | sing | 1.48Å | 1.49Å | |
| C16 | C11 | sing | 1.48Å | 1.49Å | |
| C5 | C9 | doub | 1.42Å | 1.43Å | Aromatic |
| C5 | C4 | sing | 1.42Å | 1.42Å | Aromatic |
| C9 | C8 | sing | 1.39Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.41Å | 1.42Å | Aromatic |
| C4 | N1 | doub | 1.34Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.40Å | Aromatic |
| C8 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| N1 | C7 | sing | 1.31Å | 1.33Å | Aromatic |
| C15 | C19 | sing | 1.47Å | 1.45Å | Aromatic |
| C15 | C14 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C17 | sing | 1.51Å | 1.49Å | |
| C20 | C23 | sing | 1.39Å | 1.39Å | Aromatic |
| C19 | C18 | doub | 1.40Å | 1.41Å | Aromatic |
| C14 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
| C14 | N2 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | N2 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
| N2 | C25 | sing | 1.47Å | 1.45Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H12 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.08Å | 1.08Å | |
| C22 | H14 | sing | 1.08Å | 1.08Å | |
| C23 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.08Å | 1.08Å | |
| C24 | H17 | sing | 1.08Å | 1.08Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C16 | C9 | 125.6° | 120.0° |
| C24 | C16 | C11 | 120.8° | 120.0° |
| C16 | C24 | H16 | 120.0° | 120.0° |
| C16 | C24 | H17 | 120.0° | 120.0° |
| C6 | C1 | C2 | 120.5° | 120.8° |
| C1 | C6 | C5 | 120.9° | 119.7° |
| C6 | C1 | H1 | 119.7° | 119.6° |
| C1 | C6 | H4 | 119.6° | 120.2° |
| C1 | C2 | C3 | 120.8° | 121.0° |
| C2 | C1 | H1 | 119.8° | 119.5° |
| C1 | C2 | H2 | 119.6° | 119.5° |
| C6 | C5 | C9 | 124.8° | 121.4° |
| C6 | C5 | C4 | 118.4° | 119.7° |
| C5 | C6 | H4 | 119.6° | 120.1° |
| C2 | C3 | C4 | 120.3° | 119.8° |
| C2 | C3 | H3 | 119.9° | 120.1° |
| C3 | C2 | H2 | 119.6° | 119.5° |
| C9 | C16 | C11 | 113.3° | 120.0° |
| C16 | C9 | C5 | 121.3° | 121.1° |
| C16 | C9 | C8 | 119.9° | 121.1° |
| C16 | C11 | C10 | 120.4° | 120.0° |
| C16 | C11 | C12 | 120.4° | 119.9° |
| C9 | C5 | C4 | 116.6° | 118.8° |
| C5 | C9 | C8 | 118.7° | 117.9° |
| C5 | C4 | C3 | 118.9° | 119.0° |
| C5 | C4 | N1 | 122.7° | 120.0° |
| C9 | C8 | C7 | 120.5° | 119.6° |
| C9 | C8 | H5 | 119.7° | 120.2° |
| C3 | C4 | N1 | 118.4° | 121.0° |
| C4 | C3 | H3 | 119.8° | 120.2° |
| C4 | N1 | C7 | 119.0° | 121.8° |
| C11 | C10 | C15 | 120.4° | 119.7° |
| C10 | C11 | C12 | 118.8° | 120.0° |
| C11 | C10 | H6 | 119.8° | 120.2° |
| C10 | C15 | C19 | 134.1° | 133.4° |
| C10 | C15 | C14 | 119.2° | 120.1° |
| C15 | C10 | H6 | 119.8° | 120.1° |
| C11 | C12 | C13 | 121.4° | 120.4° |
| C11 | C12 | H7 | 119.3° | 119.9° |
| C8 | C7 | N1 | 122.2° | 121.9° |
| C8 | C7 | C17 | 121.0° | 119.1° |
| C7 | C8 | H5 | 119.7° | 120.2° |
| C20 | C21 | C19 | 119.7° | 119.8° |
| C21 | C20 | C23 | 120.7° | 120.2° |
| C21 | C20 | H12 | 119.7° | 119.9° |
| C20 | C21 | H13 | 120.1° | 120.0° |
| C21 | C19 | C15 | 134.1° | 133.4° |
| C21 | C19 | C18 | 119.0° | 120.1° |
| C19 | C21 | H13 | 120.1° | 120.1° |
| N1 | C7 | C17 | 116.8° | 119.0° |
| C19 | C15 | C14 | 106.4° | 106.4° |
| C15 | C19 | C18 | 106.4° | 106.5° |
| C15 | C14 | C13 | 121.0° | 119.5° |
| C15 | C14 | N2 | 109.4° | 108.4° |
| C12 | C13 | C14 | 118.9° | 120.2° |
| C12 | C13 | H8 | 120.5° | 119.9° |
| C13 | C12 | H7 | 119.3° | 119.8° |
| C7 | C17 | H11 | 109.5° | 109.4° |
| C7 | C17 | H10 | 109.5° | 109.4° |
| C7 | C17 | H9 | 109.5° | 109.5° |
| C20 | C23 | C22 | 120.6° | 120.6° |
| C23 | C20 | H12 | 119.6° | 119.9° |
| C20 | C23 | H15 | 119.7° | 119.7° |
| C19 | C18 | N2 | 109.2° | 108.4° |
| C19 | C18 | C22 | 121.3° | 119.4° |
| C13 | C14 | N2 | 129.4° | 132.1° |
| C14 | C13 | H8 | 120.5° | 119.9° |
| C14 | N2 | C18 | 108.6° | 110.3° |
| C14 | N2 | C25 | 125.7° | 124.9° |
| C23 | C22 | C18 | 118.6° | 120.0° |
| C23 | C22 | H14 | 120.7° | 120.0° |
| C22 | C23 | H15 | 119.7° | 119.7° |
| N2 | C18 | C22 | 129.2° | 132.3° |
| C18 | N2 | C25 | 125.7° | 124.8° |
| C18 | C22 | H14 | 120.7° | 120.0° |
| N2 | C25 | H19 | 109.5° | 109.4° |
| N2 | C25 | H18 | 109.5° | 109.4° |
| N2 | C25 | H20 | 109.4° | 109.4° |
| H11 | C17 | H10 | 109.5° | 109.5° |
| H11 | C17 | H9 | 109.4° | 109.5° |
| H10 | C17 | H9 | 109.5° | 109.5° |
| H16 | C24 | H17 | 120.0° | 120.0° |
| H19 | C25 | H18 | 109.5° | 109.5° |
| H19 | C25 | H20 | 109.5° | 109.5° |
| H18 | C25 | H20 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C16 | C9 | C11 | 173.6° | 180.0° |
| C24 | C16 | C9 | C5 | 55.3° | 75.0° |
| C24 | C16 | C9 | C8 | 128.8° | 105.0° |
| C24 | C16 | C11 | C10 | 51.4° | 65.0° |
| C24 | C16 | C11 | C12 | 136.0° | 115.0° |
| C16 | C24 | H16 | H17 | 180.0° | 180.0° |
| C6 | C1 | C2 | H1 | 180.0° | 179.2° |
| C1 | C6 | C5 | H4 | 180.0° | 179.3° |
| C6 | C1 | C2 | C3 | 0.3° | 0.6° |
| C1 | C6 | C5 | C9 | 174.1° | 179.4° |
| C1 | C6 | C5 | C4 | 1.6° | 0.5° |
| C6 | C1 | C2 | H2 | 179.7° | 179.5° |
| C2 | C1 | C6 | C5 | 2.6° | 0.8° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 2.9° | 0.0° |
| C1 | C2 | C3 | H3 | 177.1° | 179.7° |
| C2 | C1 | C6 | H4 | 177.4° | 179.9° |
| C6 | C5 | C9 | C16 | 12.1° | 0.0° |
| C6 | C5 | C9 | C4 | 175.9° | 179.9° |
| C6 | C5 | C9 | C8 | 172.0° | 180.0° |
| C6 | C5 | C4 | C3 | 1.5° | 0.0° |
| C6 | C5 | C4 | N1 | 174.8° | 180.0° |
| C5 | C6 | C1 | H1 | 177.4° | 180.0° |
| C2 | C3 | C4 | C5 | 3.7° | 0.3° |
| C2 | C3 | C4 | H3 | 180.0° | 179.7° |
| C2 | C3 | C4 | N1 | 172.7° | 179.8° |
| C3 | C2 | C1 | H1 | 179.7° | 179.7° |
| C16 | C9 | C5 | C8 | 175.9° | 180.0° |
| C16 | C9 | C5 | C4 | 172.0° | 180.0° |
| C9 | C16 | C11 | C10 | 122.6° | 115.0° |
| C9 | C16 | C11 | C12 | 50.0° | 65.1° |
| C16 | C9 | C8 | C7 | 173.0° | 180.0° |
| C9 | C16 | C24 | H16 | 173.2° | 180.0° |
| C9 | C16 | C24 | H17 | 6.8° | 0.0° |
| C16 | C9 | C8 | H5 | 6.9° | 0.0° |
| C11 | C16 | C9 | C5 | 131.1° | 104.9° |
| C11 | C16 | C9 | C8 | 44.8° | 75.1° |
| C16 | C11 | C10 | C12 | 172.7° | 180.0° |
| C16 | C11 | C10 | C15 | 168.4° | 179.9° |
| C16 | C11 | C12 | C13 | 168.6° | 180.0° |
| C16 | C11 | C10 | H6 | 11.6° | 0.3° |
| C16 | C11 | C12 | H7 | 11.4° | 0.0° |
| C11 | C16 | C24 | H16 | 0.0° | 0.0° |
| C11 | C16 | C24 | H17 | 180.0° | 179.9° |
| C9 | C5 | C4 | C3 | 177.6° | 180.0° |
| C9 | C5 | C4 | N1 | 1.3° | 0.1° |
| C5 | C9 | C8 | C7 | 2.9° | 0.0° |
| C9 | C5 | C6 | H4 | 5.8° | 0.2° |
| C5 | C9 | C8 | H5 | 177.1° | 180.0° |
| C4 | C5 | C9 | C8 | 3.9° | 0.0° |
| C5 | C4 | C3 | N1 | 176.4° | 179.9° |
| C5 | C4 | N1 | C7 | 2.4° | 0.1° |
| C5 | C4 | C3 | H3 | 176.3° | 180.0° |
| C4 | C5 | C6 | H4 | 178.4° | 179.8° |
| C9 | C8 | C7 | H5 | 180.0° | 180.0° |
| C9 | C8 | C7 | N1 | 0.9° | 0.0° |
| C9 | C8 | C7 | C17 | 177.3° | 180.0° |
| C3 | C4 | N1 | C7 | 173.9° | 180.0° |
| C4 | C3 | C2 | H2 | 177.1° | 180.0° |
| C4 | N1 | C7 | C8 | 3.6° | 0.1° |
| C4 | N1 | C7 | C17 | 174.7° | 180.0° |
| N1 | C4 | C3 | H3 | 7.3° | 0.1° |
| C11 | C10 | C15 | H6 | 180.0° | 179.7° |
| C11 | C10 | C15 | C19 | 170.9° | 180.0° |
| C11 | C10 | C15 | C14 | 2.3° | 0.0° |
| C10 | C11 | C12 | C13 | 4.1° | 0.0° |
| C10 | C11 | C12 | H7 | 175.9° | 180.0° |
| C15 | C10 | C11 | C12 | 4.3° | 0.0° |
| C10 | C15 | C19 | C21 | 2.2° | 0.1° |
| C10 | C15 | C19 | C14 | 173.8° | 180.0° |
| C10 | C15 | C19 | C18 | 174.1° | 180.0° |
| C10 | C15 | C14 | C13 | 0.1° | 0.0° |
| C10 | C15 | C14 | N2 | 175.8° | 180.0° |
| C11 | C12 | C13 | H7 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 1.8° | 0.0° |
| C12 | C11 | C10 | H6 | 175.7° | 179.7° |
| C11 | C12 | C13 | H8 | 178.2° | 180.0° |
| C8 | C7 | N1 | C17 | 178.3° | 180.0° |
| C8 | C7 | C17 | H11 | 178.3° | 90.0° |
| C8 | C7 | C17 | H10 | 61.7° | 30.0° |
| C8 | C7 | C17 | H9 | 58.4° | 150.0° |
| C20 | C21 | C19 | H13 | 180.0° | 180.0° |
| C20 | C21 | C19 | C15 | 173.6° | 179.9° |
| C21 | C20 | C23 | H12 | 180.0° | 179.8° |
| C20 | C21 | C19 | C18 | 2.4° | 0.0° |
| C21 | C20 | C23 | C22 | 0.4° | 0.2° |
| C21 | C20 | C23 | H15 | 179.6° | 179.9° |
| C21 | C19 | C15 | C18 | 172.0° | 179.9° |
| C21 | C19 | C15 | C14 | 171.6° | 180.0° |
| C19 | C21 | C20 | C23 | 2.6° | 0.1° |
| C21 | C19 | C18 | N2 | 173.7° | 180.0° |
| C21 | C19 | C18 | C22 | 0.0° | 0.1° |
| C19 | C21 | C20 | H12 | 177.4° | 179.9° |
| N1 | C7 | C17 | H11 | 0.0° | 90.0° |
| N1 | C7 | C17 | H10 | 120.0° | 150.0° |
| N1 | C7 | C17 | H9 | 120.0° | 30.0° |
| N1 | C7 | C8 | H5 | 179.1° | 180.0° |
| C19 | C15 | C14 | C13 | 175.0° | 180.0° |
| C19 | C15 | C14 | N2 | 0.9° | 0.0° |
| C15 | C19 | C18 | N2 | 0.3° | 0.1° |
| C15 | C19 | C18 | C22 | 173.4° | 180.0° |
| C19 | C15 | C10 | H6 | 9.2° | 0.3° |
| C15 | C19 | C21 | H13 | 6.4° | 0.0° |
| C15 | C14 | C13 | C12 | 0.3° | 0.0° |
| C14 | C15 | C19 | C18 | 0.4° | 0.0° |
| C15 | C14 | C13 | N2 | 174.9° | 180.0° |
| C15 | C14 | N2 | C18 | 1.1° | 0.1° |
| C15 | C14 | N2 | C25 | 179.2° | 180.0° |
| C14 | C15 | C10 | H6 | 177.7° | 179.7° |
| C15 | C14 | C13 | H8 | 179.6° | 180.0° |
| C12 | C13 | C14 | H8 | 180.0° | 180.0° |
| C12 | C13 | C14 | N2 | 174.6° | 180.0° |
| C7 | C17 | H11 | H10 | 120.0° | 120.0° |
| C7 | C17 | H11 | H9 | 120.0° | 120.0° |
| C7 | C17 | H10 | H9 | 120.0° | 120.0° |
| C17 | C7 | C8 | H5 | 2.7° | 0.0° |
| C20 | C23 | C22 | H15 | 180.0° | 179.9° |
| C20 | C23 | C22 | C18 | 1.9° | 0.1° |
| C23 | C20 | C21 | H13 | 177.4° | 179.9° |
| C20 | C23 | C22 | H14 | 178.1° | 180.0° |
| C19 | C18 | N2 | C14 | 0.8° | 0.1° |
| C19 | C18 | C22 | C23 | 2.1° | 0.0° |
| C19 | C18 | N2 | C22 | 173.1° | 179.9° |
| C19 | C18 | N2 | C25 | 179.5° | 180.0° |
| C18 | C19 | C21 | H13 | 177.6° | 179.9° |
| C19 | C18 | C22 | H14 | 177.9° | 179.9° |
| C13 | C14 | N2 | C18 | 174.3° | 179.9° |
| C13 | C14 | N2 | C25 | 5.4° | 0.0° |
| C14 | C13 | C12 | H7 | 178.2° | 180.0° |
| C14 | N2 | C18 | C25 | 179.7° | 179.9° |
| C14 | N2 | C18 | C22 | 172.2° | 180.0° |
| N2 | C14 | C13 | H8 | 5.4° | 0.0° |
| C14 | N2 | C25 | H19 | 180.0° | 89.9° |
| C14 | N2 | C25 | H18 | 60.0° | 150.0° |
| C14 | N2 | C25 | H20 | 60.0° | 30.0° |
| C23 | C22 | C18 | N2 | 174.5° | 179.9° |
| C23 | C22 | C18 | H14 | 180.0° | 179.9° |
| C22 | C23 | C20 | H12 | 179.6° | 180.0° |
| N2 | C18 | C22 | H14 | 5.6° | 0.0° |
| C18 | N2 | C25 | H19 | 0.4° | 90.0° |
| C18 | N2 | C25 | H18 | 119.7° | 30.1° |
| C18 | N2 | C25 | H20 | 120.4° | 150.1° |
| C22 | C18 | N2 | C25 | 7.5° | 0.1° |
| C18 | C22 | C23 | H15 | 178.1° | 180.0° |
| N2 | C25 | H19 | H18 | 120.0° | 120.0° |
| N2 | C25 | H19 | H20 | 120.0° | 119.9° |
| N2 | C25 | H18 | H20 | 119.9° | 119.9° |
| H8 | C13 | C12 | H7 | 1.8° | 0.0° |
| H12 | C20 | C21 | H13 | 2.6° | 0.1° |
| H12 | C20 | C23 | H15 | 0.4° | 0.1° |
| H3 | C3 | C2 | H2 | 2.9° | 0.2° |
| H1 | C1 | C2 | H2 | 0.3° | 0.3° |
| H1 | C1 | C6 | H4 | 2.6° | 0.8° |
| H11 | C17 | H10 | H9 | 120.0° | 120.0° |
| H14 | C22 | C23 | H15 | 1.9° | 0.1° |
| H19 | C25 | H18 | H20 | 120.0° | 120.1° |
