FI0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N11 | C12 | sing | 1.47Å | 1.48Å | |
| N11 | C16 | sing | 1.47Å | 1.49Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C18 | sing | 1.53Å | 1.51Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | O18 | sing | 1.43Å | 1.42Å | |
| C17 | C19 | sing | 1.53Å | 1.54Å | |
| C19 | N20 | sing | 1.47Å | 1.46Å | |
| C19 | C32 | sing | 1.53Å | 1.53Å | |
| C32 | C38 | sing | 1.51Å | 1.51Å | |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C38 | sing | 1.38Å | 1.38Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C36 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
| C37 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| N20 | HN20 | sing | 1.01Å | 1.00Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| N11 | H2 | sing | 1.01Å | 1.00Å | |
| N20 | H1 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | N11 | C16 | 114.1° | 111.0° |
| N11 | C12 | C13 | 112.8° | 109.5° |
| N11 | C12 | H12 | 108.4° | 109.4° |
| N11 | C12 | H12A | 108.4° | 109.5° |
| C12 | N11 | H2 | 107.9° | 111.0° |
| N11 | C16 | C17 | 109.9° | 109.4° |
| N11 | C16 | H16 | 109.3° | 109.5° |
| N11 | C16 | H16A | 109.3° | 109.5° |
| C16 | N11 | H2 | 108.0° | 111.1° |
| C12 | C13 | C14 | 112.9° | 109.5° |
| C12 | C13 | C15 | 109.5° | 109.4° |
| C13 | C12 | H12 | 108.4° | 109.5° |
| C13 | C12 | H12A | 108.4° | 109.5° |
| C12 | C13 | H13 | 107.0° | 109.5° |
| C14 | C13 | C15 | 109.1° | 109.5° |
| C14 | C13 | H13 | 107.4° | 109.5° |
| C13 | C14 | H14 | 109.5° | 109.4° |
| C13 | C14 | H14A | 109.5° | 109.4° |
| C13 | C14 | H14B | 109.4° | 109.5° |
| C13 | C15 | C18 | 110.7° | 109.4° |
| C15 | C13 | H13 | 111.0° | 109.5° |
| C13 | C15 | H15 | 109.0° | 109.5° |
| C13 | C15 | H15A | 109.0° | 109.5° |
| C18 | C15 | H15 | 109.1° | 109.5° |
| C18 | C15 | H15A | 109.0° | 109.5° |
| C15 | C18 | H18 | 109.5° | 109.5° |
| C15 | C18 | H18A | 109.5° | 109.5° |
| C15 | C18 | H18B | 109.5° | 109.5° |
| C16 | C17 | O18 | 109.2° | 109.5° |
| C16 | C17 | C19 | 114.2° | 109.5° |
| C17 | C16 | H16 | 109.3° | 109.5° |
| C17 | C16 | H16A | 109.3° | 109.4° |
| C16 | C17 | H17 | 106.5° | 109.5° |
| O18 | C17 | C19 | 109.9° | 109.5° |
| O18 | C17 | H17 | 111.2° | 109.5° |
| C17 | O18 | HO18 | 109.5° | 114.0° |
| C17 | C19 | N20 | 109.2° | 109.5° |
| C17 | C19 | C32 | 113.2° | 109.5° |
| C19 | C17 | H17 | 105.7° | 109.5° |
| C17 | C19 | H19 | 107.4° | 109.5° |
| N20 | C19 | C32 | 110.4° | 109.4° |
| N20 | C19 | H19 | 110.4° | 109.5° |
| C19 | N20 | HN20 | 109.5° | 111.0° |
| C19 | N20 | H1 | 109.4° | 111.0° |
| C19 | C32 | C38 | 107.5° | 109.5° |
| C32 | C19 | H19 | 106.1° | 109.5° |
| C19 | C32 | H32 | 110.1° | 109.5° |
| C19 | C32 | H32A | 110.1° | 109.5° |
| C32 | C38 | C33 | 119.5° | 120.0° |
| C32 | C38 | C37 | 121.0° | 120.0° |
| C38 | C32 | H32 | 110.1° | 109.4° |
| C38 | C32 | H32A | 110.1° | 109.5° |
| C34 | C33 | C38 | 121.4° | 120.0° |
| C33 | C34 | C35 | 118.8° | 120.0° |
| C34 | C33 | H33 | 119.3° | 120.0° |
| C33 | C34 | H34 | 120.6° | 120.0° |
| C33 | C38 | C37 | 119.5° | 120.0° |
| C38 | C33 | H33 | 119.3° | 120.0° |
| C34 | C35 | C36 | 120.5° | 120.0° |
| C35 | C34 | H34 | 120.6° | 120.0° |
| C34 | C35 | H35 | 119.8° | 120.0° |
| C35 | C36 | C37 | 120.1° | 120.0° |
| C36 | C35 | H35 | 119.8° | 120.0° |
| C35 | C36 | H36 | 119.9° | 120.0° |
| C36 | C37 | C38 | 119.6° | 120.0° |
| C37 | C36 | H36 | 119.9° | 120.0° |
| C36 | C37 | H37 | 120.2° | 120.0° |
| C38 | C37 | H37 | 120.2° | 120.0° |
| H12 | C12 | H12A | 110.6° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.5° |
| H14 | C14 | H14B | 109.5° | 109.5° |
| H14A | C14 | H14B | 109.5° | 109.5° |
| H15 | C15 | H15A | 109.9° | 109.5° |
| H16 | C16 | H16A | 109.6° | 109.5° |
| H18 | C18 | H18A | 109.5° | 109.4° |
| H18 | C18 | H18B | 109.5° | 109.5° |
| H18A | C18 | H18B | 109.5° | 109.4° |
| HN20 | N20 | H1 | 109.5° | 111.0° |
| H32 | C32 | H32A | 108.8° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | N11 | C16 | H2 | 120.0° | 124.0° |
| N11 | C12 | C13 | H12 | 120.0° | 119.9° |
| N11 | C12 | C13 | H12A | 120.0° | 120.0° |
| N11 | C12 | C13 | C14 | 53.3° | 64.9° |
| N11 | C12 | C13 | C15 | 175.1° | 175.0° |
| C12 | N11 | C16 | C17 | 105.6° | 180.0° |
| N11 | C12 | H12 | H12A | 118.7° | 120.0° |
| N11 | C12 | C13 | H13 | 64.6° | 55.0° |
| C12 | N11 | C16 | H16 | 14.4° | 60.0° |
| C12 | N11 | C16 | H16A | 134.4° | 60.1° |
| C16 | N11 | C12 | C13 | 83.4° | 180.0° |
| N11 | C16 | C17 | H16 | 120.0° | 120.0° |
| N11 | C16 | C17 | H16A | 120.0° | 120.0° |
| N11 | C16 | C17 | O18 | 169.9° | 65.0° |
| N11 | C16 | C17 | C19 | 66.6° | 175.0° |
| C16 | N11 | C12 | H12 | 156.6° | 60.0° |
| C16 | N11 | C12 | H12A | 36.5° | 59.9° |
| N11 | C16 | H16 | H16A | 119.8° | 120.0° |
| N11 | C16 | C17 | H17 | 49.8° | 55.0° |
| C12 | C13 | C14 | C15 | 122.0° | 120.0° |
| C12 | C13 | C14 | H13 | 117.7° | 120.0° |
| C12 | C13 | C15 | H13 | 117.9° | 120.0° |
| C12 | C13 | C15 | C18 | 69.2° | 175.0° |
| C13 | C12 | H12 | H12A | 118.7° | 120.1° |
| C12 | C13 | C14 | H14 | 180.0° | 60.0° |
| C12 | C13 | C14 | H14A | 60.0° | 180.0° |
| C12 | C13 | C14 | H14B | 60.0° | 60.0° |
| C12 | C13 | C15 | H15 | 170.8° | 65.0° |
| C12 | C13 | C15 | H15A | 50.8° | 55.0° |
| C13 | C12 | N11 | H2 | 156.5° | 56.0° |
| C14 | C13 | C15 | H13 | 118.1° | 120.0° |
| C14 | C13 | C15 | C18 | 166.8° | 65.0° |
| C14 | C13 | C12 | H12 | 66.6° | 54.9° |
| C14 | C13 | C12 | H12A | 173.3° | 175.0° |
| C13 | C14 | H14 | H14A | 120.0° | 119.9° |
| C13 | C14 | H14 | H14B | 120.0° | 120.0° |
| C13 | C14 | H14A | H14B | 120.0° | 120.0° |
| C14 | C13 | C15 | H15 | 46.7° | 55.0° |
| C14 | C13 | C15 | H15A | 73.2° | 175.0° |
| C13 | C15 | C18 | H15 | 120.0° | 120.0° |
| C13 | C15 | C18 | H15A | 120.0° | 120.0° |
| C15 | C13 | C12 | H12 | 55.1° | 65.1° |
| C15 | C13 | C12 | H12A | 64.9° | 55.0° |
| C15 | C13 | C14 | H14 | 58.1° | 59.9° |
| C15 | C13 | C14 | H14A | 178.0° | 60.0° |
| C15 | C13 | C14 | H14B | 61.9° | 180.0° |
| C13 | C15 | H15 | H15A | 119.5° | 120.0° |
| C13 | C15 | C18 | H18 | 180.0° | 180.0° |
| C13 | C15 | C18 | H18A | 60.0° | 60.0° |
| C13 | C15 | C18 | H18B | 60.0° | 60.0° |
| C18 | C15 | C13 | H13 | 48.6° | 55.0° |
| C18 | C15 | H15 | H15A | 119.5° | 120.0° |
| C15 | C18 | H18 | H18A | 120.0° | 120.0° |
| C15 | C18 | H18 | H18B | 120.0° | 120.0° |
| C15 | C18 | H18A | H18B | 120.0° | 120.0° |
| C16 | C17 | O18 | C19 | 126.0° | 120.0° |
| C16 | C17 | O18 | H17 | 117.2° | 120.0° |
| C16 | C17 | C19 | H17 | 116.8° | 120.0° |
| C16 | C17 | C19 | N20 | 163.9° | 60.0° |
| C16 | C17 | C19 | C32 | 72.7° | 180.0° |
| C17 | C16 | H16 | H16A | 119.9° | 120.0° |
| C16 | C17 | O18 | HO18 | 180.0° | 60.0° |
| C16 | C17 | C19 | H19 | 44.1° | 60.0° |
| C17 | C16 | N11 | H2 | 134.4° | 56.0° |
| O18 | C17 | C19 | H17 | 120.1° | 120.0° |
| O18 | C17 | C19 | N20 | 73.0° | 180.0° |
| O18 | C17 | C19 | C32 | 50.4° | 60.0° |
| O18 | C17 | C16 | H16 | 49.9° | 55.0° |
| O18 | C17 | C16 | H16A | 70.1° | 175.0° |
| O18 | C17 | C19 | H19 | 167.2° | 60.0° |
| C17 | C19 | N20 | C32 | 125.1° | 120.0° |
| C17 | C19 | N20 | H19 | 117.9° | 120.0° |
| C17 | C19 | C32 | H19 | 117.6° | 120.0° |
| C17 | C19 | C32 | C38 | 179.4° | 175.0° |
| C19 | C17 | C16 | H16 | 173.4° | 65.0° |
| C19 | C17 | C16 | H16A | 53.4° | 55.0° |
| C19 | C17 | O18 | HO18 | 54.0° | 60.0° |
| C17 | C19 | N20 | HN20 | 180.0° | 64.0° |
| C17 | C19 | C32 | H32 | 60.6° | 65.0° |
| C17 | C19 | C32 | H32A | 59.3° | 55.0° |
| C17 | C19 | N20 | H1 | 60.0° | 60.0° |
| N20 | C19 | C32 | H19 | 119.7° | 120.0° |
| N20 | C19 | C32 | C38 | 57.9° | 65.0° |
| N20 | C19 | C17 | H17 | 47.0° | 60.0° |
| C19 | N20 | HN20 | H1 | 120.0° | 124.0° |
| N20 | C19 | C32 | H32 | 62.1° | 55.0° |
| N20 | C19 | C32 | H32A | 177.9° | 175.0° |
| C19 | C32 | C38 | H32 | 120.0° | 120.0° |
| C19 | C32 | C38 | H32A | 120.0° | 120.0° |
| C19 | C32 | C38 | C33 | 104.1° | 90.0° |
| C19 | C32 | C38 | C37 | 75.9° | 90.0° |
| C32 | C19 | C17 | H17 | 170.4° | 60.0° |
| C32 | C19 | N20 | HN20 | 54.9° | 176.0° |
| C19 | C32 | H32 | H32A | 120.8° | 120.0° |
| C32 | C19 | N20 | H1 | 174.9° | 60.0° |
| C32 | C38 | C33 | C34 | 178.3° | 180.0° |
| C32 | C38 | C33 | C37 | 180.0° | 179.9° |
| C32 | C38 | C37 | C36 | 179.0° | 180.0° |
| C38 | C32 | C19 | H19 | 61.8° | 55.0° |
| C38 | C32 | H32 | H32A | 120.8° | 120.0° |
| C32 | C38 | C33 | H33 | 1.6° | 0.3° |
| C32 | C38 | C37 | H37 | 1.0° | 0.1° |
| C34 | C33 | C38 | H33 | 180.0° | 179.7° |
| C33 | C34 | C35 | H34 | 180.0° | 180.0° |
| C33 | C34 | C35 | C36 | 1.9° | 0.1° |
| C34 | C33 | C38 | C37 | 1.7° | 0.0° |
| C33 | C34 | C35 | H35 | 178.1° | 179.9° |
| C38 | C33 | C34 | C35 | 2.1° | 0.0° |
| C33 | C38 | C37 | C36 | 1.0° | 0.1° |
| C33 | C38 | C32 | H32 | 15.9° | 30.0° |
| C33 | C38 | C32 | H32A | 135.9° | 150.0° |
| C38 | C33 | C34 | H34 | 177.9° | 180.0° |
| C33 | C38 | C37 | H37 | 179.0° | 180.0° |
| C34 | C35 | C36 | H35 | 180.0° | 180.0° |
| C34 | C35 | C36 | C37 | 1.3° | 0.1° |
| C35 | C34 | C33 | H33 | 177.9° | 179.8° |
| C34 | C35 | C36 | H36 | 178.7° | 180.0° |
| C35 | C36 | C37 | H36 | 180.0° | 179.8° |
| C35 | C36 | C37 | C38 | 0.8° | 0.1° |
| C36 | C35 | C34 | H34 | 178.1° | 180.0° |
| C35 | C36 | C37 | H37 | 179.2° | 180.0° |
| C36 | C37 | C38 | H37 | 180.0° | 179.9° |
| C37 | C36 | C35 | H35 | 178.7° | 179.9° |
| C37 | C38 | C32 | H32 | 164.1° | 150.0° |
| C37 | C38 | C32 | H32A | 44.1° | 30.1° |
| C37 | C38 | C33 | H33 | 178.3° | 179.8° |
| C38 | C37 | C36 | H36 | 179.2° | 180.0° |
| H12 | C12 | C13 | H13 | 175.4° | 174.9° |
| H12 | C12 | N11 | H2 | 36.5° | 64.0° |
| H12A | C12 | C13 | H13 | 55.4° | 65.0° |
| H12A | C12 | N11 | H2 | 83.5° | 176.0° |
| H13 | C13 | C14 | H14 | 62.3° | 180.0° |
| H13 | C13 | C14 | H14A | 57.7° | 60.1° |
| H13 | C13 | C14 | H14B | 177.7° | 60.0° |
| H13 | C13 | C15 | H15 | 71.4° | 175.0° |
| H13 | C13 | C15 | H15A | 168.6° | 65.0° |
| H14 | C14 | H14A | H14B | 120.0° | 120.1° |
| H15 | C15 | C18 | H18 | 60.0° | 60.0° |
| H15 | C15 | C18 | H18A | 180.0° | 180.0° |
| H15 | C15 | C18 | H18B | 60.0° | 60.0° |
| H15A | C15 | C18 | H18 | 60.0° | 60.0° |
| H15A | C15 | C18 | H18A | 60.0° | 60.0° |
| H15A | C15 | C18 | H18B | 180.0° | 180.0° |
| H16 | C16 | C17 | H17 | 70.2° | 175.0° |
| H16 | C16 | N11 | H2 | 105.6° | 176.0° |
| H16A | C16 | C17 | H17 | 169.7° | 65.0° |
| H16A | C16 | N11 | H2 | 14.5° | 63.9° |
| H17 | C17 | O18 | HO18 | 62.7° | 180.0° |
| H17 | C17 | C19 | H19 | 72.7° | NaN° |
| H18 | C18 | H18A | H18B | 120.0° | 119.9° |
| H19 | C19 | N20 | HN20 | 62.1° | 56.0° |
| H19 | C19 | C32 | H32 | 178.2° | 175.0° |
| H19 | C19 | C32 | H32A | 58.2° | 65.0° |
| H19 | C19 | N20 | H1 | 57.9° | 180.0° |
| H33 | C33 | C34 | H34 | 2.1° | 0.3° |
| H34 | C34 | C35 | H35 | 1.9° | 0.0° |
| H35 | C35 | C36 | H36 | 1.3° | 0.0° |
| H36 | C36 | C37 | H37 | 0.8° | 0.1° |
