FZX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | N05 | sing | 1.33Å | 1.31Å | Aromatic |
| C01 | C02 | doub | 1.36Å | 1.37Å | Aromatic |
| N05 | C04 | doub | 1.32Å | 1.32Å | Aromatic |
| C02 | N03 | sing | 1.35Å | 1.31Å | Aromatic |
| O08 | C06 | doub | 1.22Å | 1.25Å | |
| C04 | C06 | sing | 1.47Å | 1.51Å | |
| C04 | N03 | sing | 1.37Å | 1.31Å | Aromatic |
| C06 | O07 | sing | 1.35Å | 1.25Å | |
| N03 | C09 | sing | 1.47Å | 1.44Å | |
| C09 | C10 | sing | 1.51Å | 1.53Å | |
| C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.08Å | 1.08Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C01 | H6 | sing | 1.08Å | 1.08Å | |
| C02 | H7 | sing | 1.08Å | 1.08Å | |
| O07 | H8 | sing | 0.97Å | 0.95Å | |
| C09 | H9 | sing | 1.09Å | 1.10Å | |
| C09 | H10 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N05 | C01 | C02 | 106.6° | 108.4° |
| C01 | N05 | C04 | 108.4° | 109.1° |
| N05 | C01 | H6 | 126.7° | 125.8° |
| C01 | C02 | N03 | 108.2° | 107.2° |
| C02 | C01 | H6 | 126.7° | 125.8° |
| C01 | C02 | H7 | 125.9° | 126.4° |
| N05 | C04 | C06 | 123.9° | 125.9° |
| N05 | C04 | N03 | 109.4° | 108.2° |
| C02 | N03 | C04 | 107.5° | 107.1° |
| C02 | N03 | C09 | 124.4° | 126.5° |
| N03 | C02 | H7 | 125.9° | 126.4° |
| O08 | C06 | C04 | 118.8° | 120.0° |
| O08 | C06 | O07 | 120.4° | 120.0° |
| C06 | C04 | N03 | 126.8° | 125.9° |
| C04 | C06 | O07 | 120.8° | 120.0° |
| C04 | N03 | C09 | 128.1° | 126.4° |
| C06 | O07 | H8 | 109.5° | 117.0° |
| N03 | C09 | C10 | 110.6° | 109.5° |
| N03 | C09 | H9 | 109.2° | 109.4° |
| N03 | C09 | H10 | 109.2° | 109.4° |
| C09 | C10 | C11 | 121.3° | 120.0° |
| C09 | C10 | C15 | 119.5° | 120.0° |
| C10 | C09 | H9 | 109.2° | 109.5° |
| C10 | C09 | H10 | 109.2° | 109.5° |
| C10 | C11 | C12 | 120.5° | 120.0° |
| C11 | C10 | C15 | 119.3° | 120.0° |
| C10 | C11 | H1 | 119.8° | 120.0° |
| C11 | C12 | C13 | 119.5° | 120.0° |
| C12 | C11 | H1 | 119.7° | 120.0° |
| C11 | C12 | H2 | 120.2° | 120.0° |
| C10 | C15 | C14 | 120.0° | 120.0° |
| C10 | C15 | H5 | 120.0° | 120.0° |
| C12 | C13 | C14 | 120.1° | 120.0° |
| C13 | C12 | H2 | 120.3° | 120.0° |
| C12 | C13 | H3 | 120.0° | 120.0° |
| C15 | C14 | C13 | 120.6° | 120.0° |
| C15 | C14 | H4 | 119.7° | 120.0° |
| C14 | C15 | H5 | 120.0° | 120.0° |
| C14 | C13 | H3 | 119.9° | 120.0° |
| C13 | C14 | H4 | 119.7° | 120.0° |
| H9 | C09 | H10 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N05 | C01 | C02 | H6 | 180.0° | 179.8° |
| N05 | C01 | C02 | N03 | 0.2° | 0.0° |
| C01 | N05 | C04 | C06 | 179.4° | 180.0° |
| C01 | N05 | C04 | N03 | 0.4° | 0.0° |
| N05 | C01 | C02 | H7 | 179.8° | 179.9° |
| C02 | C01 | N05 | C04 | 0.1° | 0.0° |
| C01 | C02 | N03 | H7 | 180.0° | 179.9° |
| C01 | C02 | N03 | C04 | 0.4° | 0.0° |
| C01 | C02 | N03 | C09 | 179.5° | 179.9° |
| N05 | C04 | N03 | C02 | 0.5° | 0.0° |
| N05 | C04 | C06 | O08 | 15.6° | 174.7° |
| N05 | C04 | C06 | N03 | 179.8° | 180.0° |
| N05 | C04 | C06 | O07 | 162.8° | 5.3° |
| N05 | C04 | N03 | C09 | 179.5° | 179.9° |
| C04 | N05 | C01 | H6 | 179.9° | 179.8° |
| C02 | N03 | C04 | C06 | 179.3° | 180.0° |
| C02 | N03 | C04 | C09 | 179.0° | 179.9° |
| C02 | N03 | C09 | C10 | 85.8° | 92.1° |
| N03 | C02 | C01 | H6 | 179.8° | 179.8° |
| C02 | N03 | C09 | H9 | 34.4° | 147.8° |
| C02 | N03 | C09 | H10 | 154.0° | 27.9° |
| O08 | C06 | C04 | O07 | 178.5° | 180.0° |
| O08 | C06 | C04 | N03 | 164.6° | 5.3° |
| O08 | C06 | O07 | H8 | 0.0° | 0.0° |
| C06 | C04 | N03 | C09 | 0.3° | 0.1° |
| C04 | C06 | O07 | H8 | 178.5° | 180.0° |
| N03 | C04 | C06 | O07 | 16.9° | 174.7° |
| C04 | N03 | C09 | C10 | 95.4° | 87.8° |
| C04 | N03 | C02 | H7 | 179.6° | 179.9° |
| C04 | N03 | C09 | H9 | 144.4° | 32.3° |
| C04 | N03 | C09 | H10 | 24.8° | 152.2° |
| N03 | C09 | C10 | H9 | 120.2° | 120.0° |
| N03 | C09 | C10 | H10 | 120.2° | 120.0° |
| N03 | C09 | C10 | C11 | 7.8° | 84.1° |
| N03 | C09 | C10 | C15 | 172.2° | 96.0° |
| C09 | N03 | C02 | H7 | 0.6° | 0.0° |
| N03 | C09 | H9 | H10 | 119.5° | 119.9° |
| C09 | C10 | C11 | C15 | 180.0° | 179.9° |
| C09 | C10 | C11 | C12 | 179.4° | 180.0° |
| C09 | C10 | C15 | C14 | 179.5° | 180.0° |
| C09 | C10 | C11 | H1 | 0.6° | 0.4° |
| C09 | C10 | C15 | H5 | 0.5° | 0.0° |
| C10 | C09 | H9 | H10 | 119.5° | 120.0° |
| C10 | C11 | C12 | H1 | 180.0° | 179.6° |
| C10 | C11 | C12 | C13 | 0.8° | 0.1° |
| C11 | C10 | C15 | C14 | 0.5° | 0.0° |
| C10 | C11 | C12 | H2 | 179.2° | 179.9° |
| C11 | C10 | C15 | H5 | 179.4° | 179.9° |
| C11 | C10 | C09 | H9 | 112.4° | 155.9° |
| C11 | C10 | C09 | H10 | 128.0° | 35.9° |
| C12 | C11 | C10 | C15 | 0.6° | 0.1° |
| C11 | C12 | C13 | H2 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.9° | 0.0° |
| C11 | C12 | C13 | H3 | 179.1° | 179.9° |
| C10 | C15 | C14 | H5 | 180.0° | 180.0° |
| C10 | C15 | C14 | C13 | 0.7° | 0.0° |
| C15 | C10 | C11 | H1 | 179.4° | 179.7° |
| C10 | C15 | C14 | H4 | 179.3° | 180.0° |
| C15 | C10 | C09 | H9 | 67.6° | 24.1° |
| C15 | C10 | C09 | H10 | 52.0° | 144.1° |
| C12 | C13 | C14 | C15 | 0.9° | 0.0° |
| C12 | C13 | C14 | H3 | 180.0° | 179.9° |
| C13 | C12 | C11 | H1 | 179.2° | 179.7° |
| C12 | C13 | C14 | H4 | 179.1° | 180.0° |
| C15 | C14 | C13 | H4 | 180.0° | 180.0° |
| C15 | C14 | C13 | H3 | 179.1° | 179.9° |
| C14 | C13 | C12 | H2 | 179.1° | 179.9° |
| C13 | C14 | C15 | H5 | 179.3° | 179.9° |
| H1 | C11 | C12 | H2 | 0.8° | 0.3° |
| H2 | C12 | C13 | H3 | 0.9° | 0.1° |
| H3 | C13 | C14 | H4 | 0.9° | 0.1° |
| H4 | C14 | C15 | H5 | 0.7° | 0.1° |
| H6 | C01 | C02 | H7 | 0.2° | 0.3° |
