FO0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.42Å | Aromatic |
| C16 | C15 | sing | 1.39Å | 1.36Å | Aromatic |
| C20 | C14 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | sing | 1.51Å | 1.52Å | |
| C15 | C19 | doub | 1.38Å | 1.35Å | Aromatic |
| C18 | N05 | doub | 1.32Å | 1.36Å | Aromatic |
| C14 | N04 | sing | 1.46Å | 1.45Å | |
| C19 | N05 | sing | 1.32Å | 1.32Å | Aromatic |
| N04 | C13 | sing | 1.35Å | 1.45Å | |
| O02 | C13 | doub | 1.22Å | 1.18Å | |
| C13 | C11 | sing | 1.47Å | 1.52Å | |
| N06 | C10 | sing | 1.38Å | 1.45Å | |
| C11 | C10 | doub | 1.41Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.38Å | Aromatic |
| C10 | N03 | sing | 1.32Å | 1.31Å | Aromatic |
| C12 | C07 | doub | 1.39Å | 1.38Å | Aromatic |
| N03 | C06 | doub | 1.33Å | 1.32Å | Aromatic |
| C07 | C06 | sing | 1.42Å | 1.37Å | Aromatic |
| C07 | C08 | sing | 1.46Å | 1.45Å | |
| C06 | N02 | sing | 1.34Å | 1.36Å | |
| O01 | C08 | doub | 1.22Å | 1.40Å | |
| C08 | N01 | sing | 1.35Å | 1.40Å | |
| N02 | C04 | doub | 1.33Å | 1.39Å | |
| N01 | C04 | sing | 1.37Å | 1.43Å | |
| N01 | C05 | sing | 1.37Å | 1.40Å | |
| C04 | C03 | sing | 1.41Å | 1.38Å | |
| C05 | C01 | doub | 1.35Å | 1.39Å | |
| C03 | C09 | sing | 1.51Å | 1.53Å | |
| C03 | C02 | doub | 1.36Å | 1.43Å | |
| C01 | C02 | sing | 1.40Å | 1.44Å | |
| C17 | H1 | sing | 1.08Å | 1.08Å | |
| C20 | H2 | sing | 1.09Å | 1.10Å | |
| C20 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.08Å | 1.08Å | |
| C02 | H6 | sing | 1.08Å | 1.08Å | |
| C05 | H7 | sing | 1.08Å | 1.08Å | |
| C09 | H8 | sing | 1.09Å | 1.10Å | |
| C09 | H9 | sing | 1.09Å | 1.10Å | |
| C09 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.08Å | 1.08Å | |
| C18 | H14 | sing | 1.08Å | 1.08Å | |
| C19 | H15 | sing | 1.08Å | 1.08Å | |
| N04 | H17 | sing | 0.97Å | 1.00Å | |
| N06 | H18 | sing | 0.97Å | 1.00Å | |
| N06 | H19 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C17 | C18 | 118.8° | 119.2° |
| C17 | C16 | C15 | 119.9° | 118.4° |
| C16 | C17 | H1 | 120.6° | 120.4° |
| C17 | C16 | H13 | 120.1° | 120.8° |
| C17 | C18 | N05 | 118.6° | 120.7° |
| C18 | C17 | H1 | 120.6° | 120.4° |
| C17 | C18 | H14 | 120.7° | 119.6° |
| C16 | C15 | C14 | 120.7° | 120.4° |
| C16 | C15 | C19 | 119.0° | 119.2° |
| C15 | C16 | H13 | 120.0° | 120.8° |
| C20 | C14 | C15 | 110.3° | 109.5° |
| C20 | C14 | N04 | 106.3° | 109.5° |
| C14 | C20 | H2 | 109.5° | 109.5° |
| C14 | C20 | H3 | 109.5° | 109.5° |
| C14 | C20 | H4 | 109.5° | 109.5° |
| C20 | C14 | H12 | 109.0° | 109.5° |
| C14 | C15 | C19 | 120.3° | 120.4° |
| C15 | C14 | N04 | 112.2° | 109.4° |
| C15 | C14 | H12 | 109.1° | 109.5° |
| C15 | C19 | N05 | 123.3° | 120.8° |
| C15 | C19 | H15 | 118.4° | 119.6° |
| C18 | N05 | C19 | 120.4° | 121.7° |
| N05 | C18 | H14 | 120.7° | 119.6° |
| C14 | N04 | C13 | 121.5° | 120.0° |
| N04 | C14 | H12 | 109.9° | 109.5° |
| C14 | N04 | H17 | 119.3° | 120.0° |
| N05 | C19 | H15 | 118.3° | 119.6° |
| N04 | C13 | O02 | 121.3° | 120.0° |
| N04 | C13 | C11 | 117.8° | 120.0° |
| C13 | N04 | H17 | 119.2° | 120.0° |
| O02 | C13 | C11 | 120.8° | 120.0° |
| C13 | C11 | C10 | 119.8° | 120.4° |
| C13 | C11 | C12 | 122.2° | 120.4° |
| N06 | C10 | C11 | 120.4° | 119.3° |
| N06 | C10 | N03 | 118.2° | 119.4° |
| C10 | N06 | H18 | 109.5° | 120.0° |
| C10 | N06 | H19 | 109.5° | 120.0° |
| C10 | C11 | C12 | 117.9° | 119.2° |
| C11 | C10 | N03 | 121.3° | 121.3° |
| C11 | C12 | C07 | 119.9° | 118.0° |
| C11 | C12 | H11 | 120.1° | 121.0° |
| C10 | N03 | C06 | 121.4° | 121.7° |
| C12 | C07 | C06 | 118.0° | 119.8° |
| C12 | C07 | C08 | 123.0° | 121.8° |
| C07 | C12 | H11 | 120.1° | 121.0° |
| N03 | C06 | C07 | 121.5° | 120.0° |
| N03 | C06 | N02 | 116.4° | 121.2° |
| C06 | C07 | C08 | 119.0° | 118.3° |
| C07 | C06 | N02 | 122.1° | 118.8° |
| C07 | C08 | O01 | 120.1° | 121.1° |
| C07 | C08 | N01 | 118.8° | 117.8° |
| C06 | N02 | C04 | 121.0° | 122.2° |
| O01 | C08 | N01 | 121.1° | 121.1° |
| C08 | N01 | C04 | 119.7° | 120.5° |
| C08 | N01 | C05 | 121.5° | 118.9° |
| N02 | C04 | N01 | 119.4° | 122.3° |
| N02 | C04 | C03 | 118.6° | 118.5° |
| C04 | N01 | C05 | 118.8° | 120.6° |
| N01 | C04 | C03 | 122.0° | 119.2° |
| N01 | C05 | C01 | 121.0° | 120.8° |
| N01 | C05 | H7 | 119.5° | 119.6° |
| C04 | C03 | C09 | 120.5° | 120.2° |
| C04 | C03 | C02 | 118.7° | 119.6° |
| C05 | C01 | C02 | 119.6° | 120.1° |
| C05 | C01 | H5 | 120.2° | 120.0° |
| C01 | C05 | H7 | 119.5° | 119.6° |
| C09 | C03 | C02 | 120.8° | 120.2° |
| C03 | C09 | H8 | 109.5° | 109.5° |
| C03 | C09 | H9 | 109.5° | 109.5° |
| C03 | C09 | H10 | 109.4° | 109.5° |
| C03 | C02 | C01 | 120.0° | 119.7° |
| C03 | C02 | H6 | 120.0° | 120.1° |
| C02 | C01 | H5 | 120.2° | 120.0° |
| C01 | C02 | H6 | 120.0° | 120.2° |
| H2 | C20 | H3 | 109.4° | 109.4° |
| H2 | C20 | H4 | 109.5° | 109.5° |
| H3 | C20 | H4 | 109.5° | 109.5° |
| H8 | C09 | H9 | 109.4° | 109.5° |
| H8 | C09 | H10 | 109.5° | 109.5° |
| H9 | C09 | H10 | 109.5° | 109.4° |
| H18 | N06 | H19 | 109.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C17 | C18 | H1 | 180.0° | 180.0° |
| C17 | C16 | C15 | H13 | 180.0° | 180.0° |
| C17 | C16 | C15 | C14 | 179.6° | 180.0° |
| C17 | C16 | C15 | C19 | 0.7° | 0.2° |
| C16 | C17 | C18 | N05 | 0.6° | 0.2° |
| C16 | C17 | C18 | H14 | 179.4° | 179.9° |
| C18 | C17 | C16 | C15 | 0.4° | 0.0° |
| C17 | C18 | N05 | H14 | 180.0° | 179.9° |
| C17 | C18 | N05 | C19 | 1.2° | 0.2° |
| C18 | C17 | C16 | H13 | 179.6° | 179.9° |
| C16 | C15 | C14 | C20 | 50.1° | 99.7° |
| C16 | C15 | C14 | C19 | 179.7° | 179.7° |
| C16 | C15 | C14 | N04 | 168.4° | 140.3° |
| C16 | C15 | C19 | N05 | 1.3° | 0.3° |
| C15 | C16 | C17 | H1 | 179.6° | 180.0° |
| C16 | C15 | C14 | H12 | 69.6° | 20.3° |
| C16 | C15 | C19 | H15 | 178.8° | 179.8° |
| C20 | C14 | C15 | N04 | 118.3° | 120.0° |
| C20 | C14 | C15 | H12 | 119.6° | 120.0° |
| C20 | C14 | C15 | C19 | 129.6° | 80.0° |
| C20 | C14 | N04 | H12 | 117.8° | 120.0° |
| C20 | C14 | N04 | C13 | 154.1° | 85.0° |
| C14 | C20 | H2 | H3 | 120.0° | 120.0° |
| C14 | C20 | H2 | H4 | 120.0° | 120.0° |
| C14 | C20 | H3 | H4 | 120.0° | 120.0° |
| C20 | C14 | N04 | H17 | 25.9° | 95.0° |
| C15 | C14 | N04 | H12 | 121.6° | 120.0° |
| C14 | C15 | C19 | N05 | 179.1° | 180.0° |
| C15 | C14 | N04 | C13 | 85.2° | 155.0° |
| C15 | C14 | C20 | H2 | 180.0° | 180.0° |
| C15 | C14 | C20 | H3 | 60.0° | 60.0° |
| C15 | C14 | C20 | H4 | 60.0° | 60.0° |
| C14 | C15 | C16 | H13 | 0.4° | 0.0° |
| C14 | C15 | C19 | H15 | 0.9° | 0.1° |
| C15 | C14 | N04 | H17 | 94.8° | 25.0° |
| C15 | C19 | N05 | C18 | 1.5° | 0.0° |
| C19 | C15 | C14 | N04 | 11.3° | 40.0° |
| C15 | C19 | N05 | H15 | 180.0° | 179.9° |
| C19 | C15 | C14 | H12 | 110.8° | 160.0° |
| C19 | C15 | C16 | H13 | 179.3° | 179.7° |
| N05 | C18 | C17 | H1 | 179.4° | 179.8° |
| C18 | N05 | C19 | H15 | 178.5° | 180.0° |
| C14 | N04 | C13 | H17 | 180.0° | 180.0° |
| C14 | N04 | C13 | O02 | 0.1° | 0.0° |
| C14 | N04 | C13 | C11 | 177.3° | 180.0° |
| N04 | C14 | C20 | H2 | 58.1° | 60.0° |
| N04 | C14 | C20 | H3 | 61.9° | 60.0° |
| N04 | C14 | C20 | H4 | 178.1° | 180.0° |
| C19 | N05 | C18 | H14 | 178.9° | 179.9° |
| N04 | C13 | O02 | C11 | 177.3° | 180.0° |
| N04 | C13 | C11 | C10 | 135.6° | 174.1° |
| N04 | C13 | C11 | C12 | 41.3° | 6.0° |
| C13 | N04 | C14 | H12 | 36.3° | 35.0° |
| O02 | C13 | C11 | C10 | 41.8° | 6.0° |
| O02 | C13 | C11 | C12 | 141.3° | 174.0° |
| O02 | C13 | N04 | H17 | 179.9° | 180.0° |
| C13 | C11 | C10 | N06 | 2.5° | 0.2° |
| C13 | C11 | C10 | C12 | 177.0° | 179.9° |
| C13 | C11 | C10 | N03 | 178.5° | 180.0° |
| C13 | C11 | C12 | C07 | 178.1° | 180.0° |
| C13 | C11 | C12 | H11 | 1.9° | 0.0° |
| C11 | C13 | N04 | H17 | 2.8° | 0.0° |
| N06 | C10 | C11 | N03 | 179.0° | 179.7° |
| N06 | C10 | C11 | C12 | 179.6° | 179.7° |
| N06 | C10 | N03 | C06 | 179.9° | 179.7° |
| C10 | N06 | H18 | H19 | 120.0° | 180.0° |
| C10 | C11 | C12 | C07 | 1.1° | 0.0° |
| C11 | C10 | N03 | C06 | 1.1° | 0.0° |
| C10 | C11 | C12 | H11 | 178.9° | 180.0° |
| C11 | C10 | N06 | H18 | 179.0° | 174.7° |
| C11 | C10 | N06 | H19 | 61.0° | 5.3° |
| C12 | C11 | C10 | N03 | 1.5° | 0.0° |
| C11 | C12 | C07 | H11 | 180.0° | 180.0° |
| C11 | C12 | C07 | C06 | 0.5° | 0.0° |
| C11 | C12 | C07 | C08 | 179.4° | 179.9° |
| C10 | N03 | C06 | C07 | 0.4° | 0.0° |
| C10 | N03 | C06 | N02 | 179.9° | 180.0° |
| N03 | C10 | N06 | H18 | 0.0° | 5.6° |
| N03 | C10 | N06 | H19 | 120.0° | 174.4° |
| C12 | C07 | C06 | N03 | 0.1° | 0.0° |
| C12 | C07 | C06 | C08 | 179.9° | 180.0° |
| C12 | C07 | C06 | N02 | 179.8° | 180.0° |
| C12 | C07 | C08 | O01 | 0.1° | 0.1° |
| C12 | C07 | C08 | N01 | 179.8° | 180.0° |
| N03 | C06 | C07 | N02 | 179.7° | 180.0° |
| N03 | C06 | C07 | C08 | 179.8° | 180.0° |
| N03 | C06 | N02 | C04 | 179.7° | 179.9° |
| C06 | C07 | C08 | O01 | 179.8° | 180.0° |
| C06 | C07 | C08 | N01 | 0.1° | 0.0° |
| C07 | C06 | N02 | C04 | 0.0° | 0.1° |
| C06 | C07 | C12 | H11 | 179.5° | 180.0° |
| C08 | C07 | C06 | N02 | 0.1° | 0.1° |
| C07 | C08 | O01 | N01 | 179.7° | 179.9° |
| C07 | C08 | N01 | C04 | 0.0° | 0.1° |
| C07 | C08 | N01 | C05 | 179.9° | 180.0° |
| C08 | C07 | C12 | H11 | 0.6° | 0.1° |
| C06 | N02 | C04 | N01 | 0.0° | 0.1° |
| C06 | N02 | C04 | C03 | 179.8° | 180.0° |
| O01 | C08 | N01 | C04 | 179.8° | 180.0° |
| O01 | C08 | N01 | C05 | 0.3° | 0.0° |
| C08 | N01 | C04 | N02 | 0.0° | 0.1° |
| C08 | N01 | C04 | C05 | 179.9° | 180.0° |
| C08 | N01 | C04 | C03 | 179.8° | 180.0° |
| C08 | N01 | C05 | C01 | 179.9° | 180.0° |
| C08 | N01 | C05 | H7 | 0.1° | 0.0° |
| N02 | C04 | N01 | C03 | 179.8° | 179.9° |
| N02 | C04 | N01 | C05 | 179.9° | 179.9° |
| N02 | C04 | C03 | C09 | 0.4° | 0.1° |
| N02 | C04 | C03 | C02 | 179.9° | 179.9° |
| C04 | N01 | C05 | C01 | 0.0° | 0.0° |
| N01 | C04 | C03 | C09 | 179.8° | 180.0° |
| N01 | C04 | C03 | C02 | 0.1° | 0.0° |
| C04 | N01 | C05 | H7 | 180.0° | 179.9° |
| C05 | N01 | C04 | C03 | 0.1° | 0.0° |
| N01 | C05 | C01 | H7 | 180.0° | 180.0° |
| N01 | C05 | C01 | C02 | 0.1° | 0.0° |
| N01 | C05 | C01 | H5 | 179.9° | 179.9° |
| C04 | C03 | C09 | C02 | 179.7° | 180.0° |
| C04 | C03 | C02 | C01 | 0.0° | 0.0° |
| C04 | C03 | C02 | H6 | 180.0° | 180.0° |
| C04 | C03 | C09 | H8 | 180.0° | 180.0° |
| C04 | C03 | C09 | H9 | 60.0° | 60.0° |
| C04 | C03 | C09 | H10 | 60.0° | 60.0° |
| C05 | C01 | C02 | C03 | 0.1° | 0.0° |
| C05 | C01 | C02 | H5 | 180.0° | 179.9° |
| C05 | C01 | C02 | H6 | 179.9° | 180.0° |
| C09 | C03 | C02 | C01 | 179.7° | 180.0° |
| C09 | C03 | C02 | H6 | 0.3° | 0.0° |
| C03 | C09 | H8 | H9 | 120.0° | 120.0° |
| C03 | C09 | H8 | H10 | 120.0° | 120.0° |
| C03 | C09 | H9 | H10 | 120.0° | 120.0° |
| C03 | C02 | C01 | H6 | 180.0° | 180.0° |
| C03 | C02 | C01 | H5 | 179.9° | 179.9° |
| C02 | C03 | C09 | H8 | 0.3° | 0.0° |
| C02 | C03 | C09 | H9 | 120.3° | 120.0° |
| C02 | C03 | C09 | H10 | 119.7° | 120.0° |
| C02 | C01 | C05 | H7 | 179.9° | 180.0° |
| H1 | C17 | C16 | H13 | 0.4° | 0.0° |
| H1 | C17 | C18 | H14 | 0.6° | 0.1° |
| H2 | C20 | H3 | H4 | 120.0° | 120.0° |
| H2 | C20 | C14 | H12 | 60.3° | 60.0° |
| H3 | C20 | C14 | H12 | 179.7° | 180.0° |
| H4 | C20 | C14 | H12 | 59.7° | 60.0° |
| H5 | C01 | C02 | H6 | 0.1° | 0.0° |
| H5 | C01 | C05 | H7 | 0.1° | 0.1° |
| H8 | C09 | H9 | H10 | 120.0° | 120.0° |
| H12 | C14 | N04 | H17 | 143.7° | 145.0° |
