FNT
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.40Å | 1.38Å | Aromatic |
| C1 | C6 | sing | 1.36Å | 1.38Å | Aromatic |
| CL1 | C7 | sing | 1.74Å | 1.72Å | |
| C2 | C3 | sing | 1.42Å | 1.35Å | Aromatic |
| C2 | C7 | sing | 1.41Å | 1.37Å | Aromatic |
| C3 | C4 | doub | 1.40Å | 1.38Å | Aromatic |
| C3 | C10 | sing | 1.41Å | 1.38Å | Aromatic |
| C4 | C5 | sing | 1.36Å | 1.37Å | Aromatic |
| C5 | C6 | doub | 1.39Å | 1.37Å | Aromatic |
| C7 | N8 | doub | 1.31Å | 1.33Å | Aromatic |
| N8 | C9 | sing | 1.34Å | 1.32Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | C12 | sing | 1.47Å | 1.41Å | |
| C08 | C15 | sing | 1.53Å | 1.51Å | |
| C10 | O19 | sing | 1.35Å | 1.38Å | |
| C12 | O13 | doub | 1.22Å | 1.31Å | |
| C12 | N14 | sing | 1.35Å | 1.33Å | |
| N14 | C15 | sing | 1.47Å | 1.41Å | |
| C15 | C16 | sing | 1.51Å | 1.52Å | |
| C16 | O17 | doub | 1.21Å | 1.23Å | |
| C16 | O18 | sing | 1.34Å | 1.24Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C08 | H08 | sing | 1.09Å | 1.10Å | |
| C08 | H08A | sing | 1.09Å | 1.10Å | |
| C08 | H08B | sing | 1.09Å | 1.10Å | |
| N14 | HN14 | sing | 0.97Å | 1.00Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| O19 | HO19 | sing | 0.97Å | 0.95Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 119.4° | 119.6° |
| C1 | C2 | C3 | 121.0° | 119.3° |
| C1 | C2 | C7 | 120.9° | 121.8° |
| C2 | C1 | H1 | 120.3° | 120.2° |
| C1 | C6 | C5 | 120.2° | 121.0° |
| C6 | C1 | H1 | 120.3° | 120.2° |
| C1 | C6 | H6 | 119.9° | 119.5° |
| CL1 | C7 | C2 | 121.1° | 119.8° |
| CL1 | C7 | N8 | 116.4° | 119.8° |
| C3 | C2 | C7 | 118.1° | 118.9° |
| C2 | C3 | C4 | 119.2° | 119.7° |
| C2 | C3 | C10 | 119.0° | 118.3° |
| C2 | C7 | N8 | 122.5° | 120.4° |
| C4 | C3 | C10 | 121.7° | 122.0° |
| C3 | C4 | C5 | 120.8° | 119.5° |
| C3 | C4 | H4 | 119.6° | 120.3° |
| C3 | C10 | C9 | 121.8° | 118.4° |
| C3 | C10 | O19 | 118.2° | 120.8° |
| C4 | C5 | C6 | 119.4° | 120.9° |
| C5 | C4 | H4 | 119.6° | 120.2° |
| C4 | C5 | H5 | 120.3° | 119.5° |
| C6 | C5 | H5 | 120.3° | 119.5° |
| C5 | C6 | H6 | 119.9° | 119.5° |
| C7 | N8 | C9 | 122.0° | 122.7° |
| N8 | C9 | C10 | 116.6° | 121.3° |
| N8 | C9 | C12 | 117.2° | 119.4° |
| C10 | C9 | C12 | 126.2° | 119.4° |
| C9 | C10 | O19 | 120.0° | 120.8° |
| C9 | C12 | O13 | 122.9° | 120.0° |
| C9 | C12 | N14 | 119.1° | 120.0° |
| C08 | C15 | N14 | 109.3° | 109.5° |
| C08 | C15 | C16 | 108.0° | 109.5° |
| C15 | C08 | H08 | 109.5° | 109.4° |
| C15 | C08 | H08A | 109.5° | 109.4° |
| C15 | C08 | H08B | 109.4° | 109.4° |
| C08 | C15 | H15 | 109.4° | 109.5° |
| C10 | O19 | HO19 | 109.5° | 114.1° |
| O13 | C12 | N14 | 117.9° | 120.0° |
| C12 | N14 | C15 | 119.9° | 120.0° |
| C12 | N14 | HN14 | 120.0° | 120.0° |
| N14 | C15 | C16 | 110.1° | 109.5° |
| C15 | N14 | HN14 | 120.0° | 120.0° |
| N14 | C15 | H15 | 110.8° | 109.4° |
| C15 | C16 | O17 | 116.1° | 120.0° |
| C15 | C16 | O18 | 119.6° | 120.0° |
| C16 | C15 | H15 | 109.2° | 109.5° |
| O17 | C16 | O18 | 124.3° | 120.0° |
| C16 | O18 | HO18 | 109.5° | 117.0° |
| H08 | C08 | H08A | 109.5° | 109.5° |
| H08 | C08 | H08B | 109.5° | 109.5° |
| H08A | C08 | H08B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.8° |
| C1 | C2 | C7 | CL1 | 0.4° | 0.0° |
| C1 | C2 | C3 | C7 | 179.6° | 180.0° |
| C1 | C2 | C3 | C4 | 1.2° | 0.0° |
| C1 | C2 | C3 | C10 | 179.9° | 180.0° |
| C2 | C1 | C6 | C5 | 0.2° | 0.0° |
| C1 | C2 | C7 | N8 | 178.6° | 180.0° |
| C2 | C1 | C6 | H6 | 179.7° | 180.0° |
| C6 | C1 | C2 | C3 | 0.6° | 0.0° |
| C6 | C1 | C2 | C7 | 179.8° | 179.9° |
| C1 | C6 | C5 | C4 | 0.5° | 0.0° |
| C1 | C6 | C5 | H6 | 180.0° | 180.0° |
| C1 | C6 | C5 | H5 | 179.5° | 180.0° |
| CL1 | C7 | C2 | C3 | 179.2° | 180.0° |
| CL1 | C7 | C2 | N8 | 179.0° | 180.0° |
| CL1 | C7 | N8 | C9 | 178.7° | 180.0° |
| C2 | C3 | C4 | C10 | 178.6° | 179.9° |
| C2 | C3 | C4 | C5 | 1.0° | 0.0° |
| C3 | C2 | C7 | N8 | 1.8° | 0.0° |
| C2 | C3 | C10 | C9 | 0.3° | 0.0° |
| C2 | C3 | C10 | O19 | 179.5° | 180.0° |
| C3 | C2 | C1 | H1 | 179.4° | 179.7° |
| C2 | C3 | C4 | H4 | 179.0° | 180.0° |
| C7 | C2 | C3 | C4 | 179.2° | 179.9° |
| C7 | C2 | C3 | C10 | 0.5° | 0.0° |
| C2 | C7 | N8 | C9 | 2.3° | 0.1° |
| C7 | C2 | C1 | H1 | 0.2° | 0.3° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.0° |
| C4 | C3 | C10 | C9 | 178.3° | 180.0° |
| C4 | C3 | C10 | O19 | 1.9° | 0.0° |
| C3 | C4 | C5 | H5 | 179.9° | 180.0° |
| C10 | C3 | C4 | C5 | 179.6° | 180.0° |
| C3 | C10 | C9 | N8 | 0.1° | 0.0° |
| C3 | C10 | C9 | O19 | 179.8° | 180.0° |
| C3 | C10 | C9 | C12 | 178.7° | 180.0° |
| C10 | C3 | C4 | H4 | 0.4° | 0.0° |
| C3 | C10 | O19 | HO19 | 180.0° | 90.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | H6 | 179.5° | 180.0° |
| C5 | C6 | C1 | H1 | 179.7° | 179.7° |
| C6 | C5 | C4 | H4 | 179.9° | 180.0° |
| C7 | N8 | C9 | C10 | 1.4° | 0.1° |
| C7 | N8 | C9 | C12 | 179.9° | 180.0° |
| N8 | C9 | C10 | C12 | 178.6° | 180.0° |
| N8 | C9 | C10 | O19 | 179.9° | 180.0° |
| N8 | C9 | C12 | O13 | 22.1° | 180.0° |
| N8 | C9 | C12 | N14 | 161.0° | 0.1° |
| C10 | C9 | C12 | O13 | 156.4° | 0.0° |
| C10 | C9 | C12 | N14 | 20.4° | 180.0° |
| C9 | C10 | O19 | HO19 | 0.2° | 90.0° |
| C12 | C9 | C10 | O19 | 1.5° | 0.0° |
| C9 | C12 | O13 | N14 | 176.9° | 180.0° |
| C9 | C12 | N14 | C15 | 176.3° | 180.0° |
| C9 | C12 | N14 | HN14 | 3.7° | 0.1° |
| C08 | C15 | N14 | C12 | 66.1° | 85.0° |
| C08 | C15 | N14 | C16 | 118.4° | 120.0° |
| C08 | C15 | N14 | H15 | 120.7° | 120.0° |
| C08 | C15 | C16 | H15 | 118.8° | 120.0° |
| C08 | C15 | C16 | O17 | 63.1° | 120.0° |
| C08 | C15 | C16 | O18 | 117.4° | 60.0° |
| C15 | C08 | H08 | H08A | 120.0° | 120.0° |
| C15 | C08 | H08 | H08B | 120.0° | 120.0° |
| C15 | C08 | H08A | H08B | 120.0° | 120.0° |
| C08 | C15 | N14 | HN14 | 113.9° | 95.0° |
| O13 | C12 | N14 | C15 | 6.7° | 0.0° |
| O13 | C12 | N14 | HN14 | 173.4° | 180.0° |
| C12 | N14 | C15 | HN14 | 180.0° | 180.0° |
| C12 | N14 | C15 | C16 | 175.5° | 155.0° |
| C12 | N14 | C15 | H15 | 54.6° | 35.0° |
| N14 | C15 | C16 | H15 | 121.9° | 120.0° |
| N14 | C15 | C16 | O17 | 177.7° | 0.1° |
| N14 | C15 | C16 | O18 | 1.9° | 180.0° |
| N14 | C15 | C08 | H08 | 180.0° | 180.0° |
| N14 | C15 | C08 | H08A | 60.0° | 60.0° |
| N14 | C15 | C08 | H08B | 60.0° | 60.0° |
| C15 | C16 | O17 | O18 | 179.5° | 179.9° |
| C16 | C15 | C08 | H08 | 60.2° | 60.0° |
| C16 | C15 | C08 | H08A | 179.7° | 180.0° |
| C16 | C15 | C08 | H08B | 59.7° | 60.0° |
| C16 | C15 | N14 | HN14 | 4.5° | 25.0° |
| C15 | C16 | O18 | HO18 | 179.5° | 180.0° |
| O17 | C16 | C15 | H15 | 55.8° | 120.0° |
| O17 | C16 | O18 | HO18 | 0.0° | 0.0° |
| O18 | C16 | C15 | H15 | 123.8° | 60.0° |
| H1 | C1 | C6 | H6 | 0.3° | 0.2° |
| H4 | C4 | C5 | H5 | 0.1° | 0.0° |
| H5 | C5 | C6 | H6 | 0.5° | 0.0° |
| H08 | C08 | H08A | H08B | 120.0° | 120.1° |
| H08 | C08 | C15 | H15 | 58.5° | 60.0° |
| H08A | C08 | C15 | H15 | 61.5° | 60.0° |
| H08B | C08 | C15 | H15 | 178.4° | 179.9° |
| HN14 | N14 | C15 | H15 | 125.4° | 145.0° |
