F33
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C4 | doub | 1.22Å | 1.21Å | |
| C4 | N | sing | 1.34Å | 1.34Å | |
| C4 | O10 | sing | 1.34Å | 1.45Å | |
| C1 | O10 | sing | 1.46Å | 1.42Å | |
| C1 | C2 | sing | 1.54Å | 1.54Å | |
| N | C5 | sing | 1.40Å | 1.41Å | |
| N | C2 | sing | 1.47Å | 1.47Å | |
| C5 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C5 | C10 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C8 | doub | 1.40Å | 1.38Å | Aromatic |
| C10 | C9 | doub | 1.38Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.40Å | 1.38Å | Aromatic |
| C8 | C11 | sing | 1.48Å | 1.48Å | |
| C11 | N2 | sing | 1.37Å | 1.35Å | |
| C11 | N1 | doub | 1.31Å | 1.35Å | |
| N2 | C18 | sing | 1.35Å | 1.34Å | |
| C18 | O1 | doub | 1.22Å | 1.26Å | |
| C18 | C17 | sing | 1.47Å | 1.48Å | |
| N1 | C12 | sing | 1.35Å | 1.36Å | |
| C12 | C17 | sing | 1.41Å | 1.46Å | Aromatic |
| C12 | C13 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | H11C | sing | 1.09Å | 1.10Å | |
| C1 | H12C | sing | 1.09Å | 1.10Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| N2 | H2 | sing | 0.97Å | 1.00Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C4 | N | 130.7° | 123.1° |
| O | C4 | O10 | 119.9° | 123.1° |
| N | C4 | O10 | 109.2° | 113.8° |
| C4 | N | C5 | 127.1° | 125.5° |
| C4 | N | C2 | 111.2° | 108.9° |
| C4 | O10 | C1 | 106.9° | 109.5° |
| O10 | C1 | C2 | 104.7° | 104.0° |
| O10 | C1 | H11C | 110.7° | 110.6° |
| O10 | C1 | H12C | 110.7° | 110.5° |
| C1 | C2 | N | 102.1° | 103.8° |
| C2 | C1 | H11C | 110.6° | 110.4° |
| C2 | C1 | H12C | 110.6° | 110.6° |
| C1 | C2 | H21C | 111.3° | 110.5° |
| C1 | C2 | H22C | 111.3° | 110.5° |
| C5 | N | C2 | 121.2° | 125.6° |
| N | C5 | C6 | 123.3° | 119.9° |
| N | C5 | C10 | 119.0° | 119.9° |
| N | C2 | H21C | 111.3° | 110.6° |
| N | C2 | H22C | 111.3° | 110.6° |
| C6 | C5 | C10 | 117.6° | 120.2° |
| C5 | C6 | C7 | 121.4° | 120.0° |
| C5 | C6 | H6 | 119.3° | 119.9° |
| C5 | C10 | C9 | 120.5° | 120.1° |
| C5 | C10 | H10 | 119.8° | 120.0° |
| C6 | C7 | C8 | 119.6° | 120.0° |
| C7 | C6 | H6 | 119.3° | 120.0° |
| C6 | C7 | H7 | 120.2° | 120.0° |
| C7 | C8 | C9 | 119.2° | 119.8° |
| C7 | C8 | C11 | 121.1° | 120.1° |
| C8 | C7 | H7 | 120.2° | 120.0° |
| C10 | C9 | C8 | 121.2° | 119.9° |
| C9 | C10 | H10 | 119.7° | 119.9° |
| C10 | C9 | H9 | 119.4° | 120.1° |
| C9 | C8 | C11 | 118.5° | 120.0° |
| C8 | C9 | H9 | 119.4° | 120.0° |
| C8 | C11 | N2 | 121.7° | 118.5° |
| C8 | C11 | N1 | 115.4° | 118.5° |
| N2 | C11 | N1 | 122.2° | 123.0° |
| C11 | N2 | C18 | 122.7° | 120.4° |
| C11 | N2 | H2 | 118.6° | 119.8° |
| C11 | N1 | C12 | 121.3° | 121.7° |
| N2 | C18 | O1 | 119.6° | 121.2° |
| N2 | C18 | C17 | 117.4° | 117.5° |
| C18 | N2 | H2 | 118.7° | 119.8° |
| O1 | C18 | C17 | 122.7° | 121.3° |
| C18 | C17 | C12 | 117.0° | 118.2° |
| C18 | C17 | C16 | 123.7° | 121.8° |
| N1 | C12 | C17 | 118.6° | 119.2° |
| N1 | C12 | C13 | 121.6° | 121.5° |
| C17 | C12 | C13 | 119.6° | 119.3° |
| C12 | C17 | C16 | 119.0° | 120.0° |
| C12 | C13 | C14 | 119.7° | 119.7° |
| C12 | C13 | H13 | 120.2° | 120.1° |
| C17 | C16 | C15 | 119.8° | 119.6° |
| C17 | C16 | H16 | 120.1° | 120.2° |
| C13 | C14 | C15 | 120.7° | 120.8° |
| C14 | C13 | H13 | 120.1° | 120.2° |
| C13 | C14 | H14 | 119.7° | 119.6° |
| C14 | C15 | C16 | 121.0° | 120.6° |
| C15 | C14 | H14 | 119.7° | 119.6° |
| C14 | C15 | H15 | 119.5° | 119.7° |
| C15 | C16 | H16 | 120.1° | 120.2° |
| C16 | C15 | H15 | 119.5° | 119.7° |
| H11C | C1 | H12C | 109.5° | 110.6° |
| H21C | C2 | H22C | 109.4° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C4 | N | O10 | 174.4° | 179.8° |
| O | C4 | O10 | C1 | 156.7° | 179.9° |
| O | C4 | N | C5 | 1.2° | 0.0° |
| O | C4 | N | C2 | 170.7° | 180.0° |
| N | C4 | O10 | C1 | 18.5° | 0.2° |
| C4 | N | C2 | C1 | 11.0° | 0.1° |
| C4 | N | C5 | C2 | 171.2° | 179.9° |
| C4 | N | C5 | C6 | 3.2° | 174.3° |
| C4 | N | C5 | C10 | 173.1° | 5.5° |
| C4 | N | C2 | H21C | 107.8° | 118.7° |
| C4 | N | C2 | H22C | 129.8° | 118.4° |
| C4 | O10 | C1 | C2 | 24.4° | 0.1° |
| O10 | C4 | N | C5 | 175.7° | 179.7° |
| O10 | C4 | N | C2 | 3.7° | 0.2° |
| C4 | O10 | C1 | H11C | 143.7° | 118.6° |
| C4 | O10 | C1 | H12C | 94.8° | 118.6° |
| O10 | C1 | C2 | H11C | 119.3° | 118.6° |
| O10 | C1 | C2 | H12C | 119.3° | 118.6° |
| O10 | C1 | C2 | N | 21.6° | 0.0° |
| O10 | C1 | H11C | H12C | 122.2° | 122.7° |
| O10 | C1 | C2 | H21C | 97.3° | 118.6° |
| O10 | C1 | C2 | H22C | 140.4° | 118.5° |
| C1 | C2 | N | C5 | 161.5° | 179.8° |
| C1 | C2 | N | H21C | 118.8° | 118.6° |
| C1 | C2 | N | H22C | 118.8° | 118.5° |
| C2 | C1 | H11C | H12C | 122.2° | 122.8° |
| C1 | C2 | H21C | H22C | 123.4° | 122.8° |
| N | C5 | C6 | C10 | 176.3° | 179.8° |
| N | C5 | C6 | C7 | 176.4° | 180.0° |
| N | C5 | C10 | C9 | 176.9° | 180.0° |
| C5 | N | C2 | H21C | 79.7° | 61.3° |
| C5 | N | C2 | H22C | 42.7° | 61.6° |
| N | C5 | C6 | H6 | 3.7° | 0.1° |
| N | C5 | C10 | H10 | 3.0° | 0.0° |
| C2 | N | C5 | C6 | 174.4° | 5.7° |
| C2 | N | C5 | C10 | 1.9° | 174.6° |
| N | C2 | C1 | H11C | 140.8° | 118.6° |
| N | C2 | C1 | H12C | 97.7° | 118.6° |
| N | C2 | H21C | H22C | 123.4° | 122.9° |
| C5 | C6 | C7 | H6 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 3.6° | 0.0° |
| C6 | C5 | C10 | C9 | 0.5° | 0.3° |
| C6 | C5 | C10 | H10 | 179.5° | 179.8° |
| C5 | C6 | C7 | H7 | 176.4° | 179.9° |
| C10 | C5 | C6 | C7 | 0.0° | 0.2° |
| C5 | C10 | C9 | H10 | 180.0° | 180.0° |
| C5 | C10 | C9 | C8 | 2.8° | 0.0° |
| C10 | C5 | C6 | H6 | 180.0° | 179.7° |
| C5 | C10 | C9 | H9 | 177.2° | 180.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 6.8° | 0.3° |
| C6 | C7 | C8 | C11 | 174.4° | 180.0° |
| C7 | C8 | C9 | C10 | 6.5° | 0.2° |
| C7 | C8 | C9 | C11 | 167.9° | 179.7° |
| C7 | C8 | C11 | N2 | 176.5° | 0.3° |
| C7 | C8 | C11 | N1 | 13.4° | 180.0° |
| C8 | C7 | C6 | H6 | 176.4° | 179.9° |
| C7 | C8 | C9 | H9 | 173.5° | 179.7° |
| C10 | C9 | C8 | H9 | 180.0° | 180.0° |
| C10 | C9 | C8 | C11 | 174.4° | 180.0° |
| C9 | C8 | C11 | N2 | 15.8° | 180.0° |
| C9 | C8 | C11 | N1 | 154.3° | 0.3° |
| C8 | C9 | C10 | H10 | 177.2° | 180.0° |
| C9 | C8 | C7 | H7 | 173.2° | 179.7° |
| C8 | C11 | N2 | N1 | 169.4° | 179.7° |
| C8 | C11 | N2 | C18 | 177.3° | 180.0° |
| C8 | C11 | N1 | C12 | 176.9° | 180.0° |
| C11 | C8 | C7 | H7 | 5.6° | 0.0° |
| C11 | C8 | C9 | H9 | 5.6° | 0.0° |
| C8 | C11 | N2 | H2 | 2.7° | 0.0° |
| C11 | N2 | C18 | H2 | 180.0° | 180.0° |
| C11 | N2 | C18 | O1 | 177.2° | 179.9° |
| C11 | N2 | C18 | C17 | 8.3° | 0.0° |
| N2 | C11 | N1 | C12 | 6.8° | 0.3° |
| N1 | C11 | N2 | C18 | 7.9° | 0.3° |
| C11 | N1 | C12 | C17 | 6.6° | 0.0° |
| C11 | N1 | C12 | C13 | 178.3° | 180.0° |
| N1 | C11 | N2 | H2 | 172.2° | 179.7° |
| N2 | C18 | O1 | C17 | 174.2° | 180.0° |
| N2 | C18 | C17 | C12 | 7.9° | 0.2° |
| N2 | C18 | C17 | C16 | 178.0° | 180.0° |
| O1 | C18 | C17 | C12 | 177.9° | 179.7° |
| O1 | C18 | C17 | C16 | 3.7° | 0.0° |
| O1 | C18 | N2 | H2 | 2.8° | 0.0° |
| C18 | C17 | C12 | N1 | 7.1° | 0.2° |
| C18 | C17 | C12 | C16 | 174.4° | 179.8° |
| C18 | C17 | C12 | C13 | 177.7° | 179.7° |
| C18 | C17 | C16 | C15 | 177.6° | 179.8° |
| C17 | C18 | N2 | H2 | 171.7° | 180.0° |
| C18 | C17 | C16 | H16 | 2.4° | 0.0° |
| N1 | C12 | C17 | C13 | 175.2° | 179.9° |
| N1 | C12 | C17 | C16 | 178.5° | 180.0° |
| N1 | C12 | C13 | C14 | 178.0° | 180.0° |
| N1 | C12 | C13 | H13 | 2.0° | 0.0° |
| C17 | C12 | C13 | C14 | 3.0° | 0.1° |
| C12 | C17 | C16 | C15 | 3.5° | 0.0° |
| C17 | C12 | C13 | H13 | 177.0° | 180.0° |
| C12 | C17 | C16 | H16 | 176.5° | 179.8° |
| C13 | C12 | C17 | C16 | 3.3° | 0.0° |
| C12 | C13 | C14 | H13 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 3.0° | 0.0° |
| C12 | C13 | C14 | H14 | 177.0° | 180.0° |
| C17 | C16 | C15 | C14 | 3.6° | 0.0° |
| C17 | C16 | C15 | H16 | 180.0° | 179.8° |
| C17 | C16 | C15 | H15 | 176.4° | 180.0° |
| C13 | C14 | C15 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 3.3° | 0.0° |
| C13 | C14 | C15 | H15 | 176.7° | 180.0° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C15 | C14 | C13 | H13 | 177.0° | 180.0° |
| C14 | C15 | C16 | H16 | 176.4° | 179.8° |
| C16 | C15 | C14 | H14 | 176.8° | 179.9° |
| H11C | C1 | C2 | H21C | 22.0° | 0.0° |
| H11C | C1 | C2 | H22C | 100.4° | 122.9° |
| H12C | C1 | C2 | H21C | 143.5° | 122.8° |
| H12C | C1 | C2 | H22C | 21.1° | 0.1° |
| H6 | C6 | C7 | H7 | 3.7° | 0.0° |
| H10 | C10 | C9 | H9 | 2.8° | 0.0° |
| H13 | C13 | C14 | H14 | 3.0° | 0.0° |
| H16 | C16 | C15 | H15 | 3.6° | 0.2° |
| H14 | C14 | C15 | H15 | 3.3° | 0.0° |
