8C1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | N11 | doub | 1.31Å | 1.32Å | Aromatic |
| C10 | C9 | sing | 1.39Å | 1.38Å | Aromatic |
| N11 | C12 | sing | 1.34Å | 1.37Å | Aromatic |
| C9 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C19 | sing | 1.53Å | 1.51Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C8 | O18 | sing | 1.36Å | 1.38Å | |
| C8 | C7 | sing | 1.41Å | 1.42Å | Aromatic |
| C19 | O18 | sing | 1.43Å | 1.46Å | |
| C19 | C24 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | sing | 1.40Å | 1.41Å | Aromatic |
| C12 | C7 | doub | 1.42Å | 1.41Å | Aromatic |
| C13 | C14 | doub | 1.39Å | 1.38Å | Aromatic |
| C7 | C6 | sing | 1.40Å | 1.43Å | Aromatic |
| C24 | N23 | sing | 1.47Å | 1.46Å | |
| O16 | C15 | doub | 1.22Å | 1.24Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| C14 | C15 | sing | 1.48Å | 1.50Å | |
| C14 | C5 | sing | 1.41Å | 1.41Å | Aromatic |
| C6 | C5 | doub | 1.36Å | 1.37Å | Aromatic |
| C15 | N17 | sing | 1.35Å | 1.34Å | |
| C5 | O4 | sing | 1.36Å | 1.38Å | |
| C22 | N23 | sing | 1.47Å | 1.47Å | |
| O4 | C2 | sing | 1.43Å | 1.46Å | |
| C3 | C2 | sing | 1.53Å | 1.50Å | |
| C2 | C1 | sing | 1.53Å | 1.49Å | |
| C6 | HC6 | sing | 1.08Å | 1.08Å | |
| C9 | HC9 | sing | 1.08Å | 1.08Å | |
| C13 | HC13 | sing | 1.08Å | 1.08Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C19 | HC19 | sing | 1.09Å | 1.10Å | |
| C1 | HC1B | sing | 1.09Å | 1.10Å | |
| C1 | HC1A | sing | 1.09Å | 1.10Å | |
| C1 | HC1C | sing | 1.09Å | 1.10Å | |
| C2 | HC2 | sing | 1.09Å | 1.10Å | |
| C3 | HC3A | sing | 1.09Å | 1.10Å | |
| C3 | HC3C | sing | 1.09Å | 1.10Å | |
| C3 | HC3B | sing | 1.09Å | 1.10Å | |
| C10 | HC10 | sing | 1.08Å | 1.08Å | |
| N17 | H17B | sing | 0.97Å | 1.00Å | |
| N17 | H17A | sing | 0.97Å | 1.00Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| N23 | HN23 | sing | 1.01Å | 1.00Å | |
| C24 | H24B | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N11 | C10 | C9 | 125.1° | 121.8° |
| C10 | N11 | C12 | 117.4° | 121.7° |
| N11 | C10 | HC10 | 117.5° | 119.1° |
| C10 | C9 | C8 | 118.1° | 119.7° |
| C10 | C9 | HC9 | 120.9° | 120.1° |
| C9 | C10 | HC10 | 117.4° | 119.1° |
| N11 | C12 | C13 | 118.2° | 120.7° |
| N11 | C12 | C7 | 122.7° | 120.0° |
| C9 | C8 | O18 | 126.1° | 121.0° |
| C9 | C8 | C7 | 119.8° | 118.0° |
| C8 | C9 | HC9 | 120.9° | 120.2° |
| C19 | C20 | C21 | 111.9° | 109.2° |
| C20 | C19 | O18 | 105.3° | 109.5° |
| C20 | C19 | C24 | 111.4° | 109.3° |
| C19 | C20 | H20B | 108.9° | 109.5° |
| C19 | C20 | H20A | 108.9° | 109.6° |
| C20 | C19 | HC19 | 110.4° | 109.5° |
| C20 | C21 | C22 | 110.6° | 109.2° |
| C21 | C20 | H20B | 108.9° | 109.5° |
| C21 | C20 | H20A | 108.8° | 109.5° |
| C20 | C21 | H21B | 109.2° | 109.5° |
| C20 | C21 | H21A | 109.2° | 109.6° |
| O18 | C8 | C7 | 113.9° | 121.0° |
| C8 | O18 | C19 | 123.1° | 117.0° |
| C8 | C7 | C12 | 116.8° | 118.8° |
| C8 | C7 | C6 | 124.2° | 121.1° |
| O18 | C19 | C24 | 108.1° | 109.5° |
| O18 | C19 | HC19 | 111.2° | 109.5° |
| C19 | C24 | N23 | 109.7° | 109.5° |
| C24 | C19 | HC19 | 110.3° | 109.5° |
| C19 | C24 | H24B | 109.4° | 109.4° |
| C19 | C24 | H24A | 109.4° | 109.5° |
| C13 | C12 | C7 | 119.1° | 119.3° |
| C12 | C13 | C14 | 121.3° | 119.6° |
| C12 | C13 | HC13 | 119.4° | 120.2° |
| C12 | C7 | C6 | 118.9° | 120.1° |
| C13 | C14 | C15 | 114.6° | 119.7° |
| C13 | C14 | C5 | 119.5° | 120.5° |
| C14 | C13 | HC13 | 119.4° | 120.2° |
| C7 | C6 | C5 | 120.2° | 119.9° |
| C7 | C6 | HC6 | 119.9° | 120.0° |
| C24 | N23 | C22 | 112.0° | 111.2° |
| C24 | N23 | HN23 | 108.9° | 111.0° |
| N23 | C24 | H24B | 109.4° | 109.5° |
| N23 | C24 | H24A | 109.4° | 109.5° |
| O16 | C15 | C14 | 119.1° | 120.0° |
| O16 | C15 | N17 | 121.6° | 120.0° |
| C21 | C22 | N23 | 110.0° | 109.5° |
| C22 | C21 | H21B | 109.2° | 109.5° |
| C22 | C21 | H21A | 109.2° | 109.5° |
| C21 | C22 | H22B | 109.3° | 109.4° |
| C21 | C22 | H22A | 109.3° | 109.4° |
| C15 | C14 | C5 | 125.8° | 119.8° |
| C14 | C15 | N17 | 119.0° | 120.0° |
| C14 | C5 | C6 | 120.9° | 120.6° |
| C14 | C5 | O4 | 115.3° | 119.7° |
| C6 | C5 | O4 | 123.7° | 119.7° |
| C5 | C6 | HC6 | 119.9° | 120.1° |
| C15 | N17 | H17B | 120.0° | 120.0° |
| C15 | N17 | H17A | 120.0° | 120.0° |
| C5 | O4 | C2 | 123.3° | 117.0° |
| N23 | C22 | H22B | 109.3° | 109.5° |
| N23 | C22 | H22A | 109.3° | 109.5° |
| C22 | N23 | HN23 | 108.8° | 111.0° |
| O4 | C2 | C3 | 109.4° | 109.5° |
| O4 | C2 | C1 | 106.5° | 109.5° |
| O4 | C2 | HC2 | 109.8° | 109.4° |
| C3 | C2 | C1 | 112.2° | 109.5° |
| C3 | C2 | HC2 | 109.3° | 109.5° |
| C2 | C3 | HC3A | 109.5° | 109.5° |
| C2 | C3 | HC3C | 109.5° | 109.5° |
| C2 | C3 | HC3B | 109.4° | 109.5° |
| C2 | C1 | HC1B | 109.5° | 109.5° |
| C2 | C1 | HC1A | 109.5° | 109.4° |
| C2 | C1 | HC1C | 109.5° | 109.4° |
| C1 | C2 | HC2 | 109.5° | 109.4° |
| H20B | C20 | H20A | 109.5° | 109.6° |
| H21B | C21 | H21A | 109.5° | 109.5° |
| HC1B | C1 | HC1A | 109.5° | 109.4° |
| HC1B | C1 | HC1C | 109.4° | 109.5° |
| HC1A | C1 | HC1C | 109.5° | 109.5° |
| HC3A | C3 | HC3C | 109.5° | 109.4° |
| HC3A | C3 | HC3B | 109.5° | 109.4° |
| HC3C | C3 | HC3B | 109.5° | 109.5° |
| H17B | N17 | H17A | 120.0° | 120.0° |
| H22B | C22 | H22A | 109.5° | 109.5° |
| H24B | C24 | H24A | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N11 | C10 | C9 | HC10 | 180.0° | 179.6° |
| N11 | C10 | C9 | C8 | 1.2° | 0.4° |
| C10 | N11 | C12 | C13 | 178.7° | 179.9° |
| C10 | N11 | C12 | C7 | 0.8° | 0.1° |
| N11 | C10 | C9 | HC9 | 178.7° | 179.7° |
| C9 | C10 | N11 | C12 | 0.2° | 0.4° |
| C10 | C9 | C8 | HC9 | 180.0° | 179.9° |
| C10 | C9 | C8 | O18 | 172.4° | 180.0° |
| C10 | C9 | C8 | C7 | 2.2° | 0.0° |
| N11 | C12 | C7 | C8 | 0.2° | 0.3° |
| N11 | C12 | C13 | C7 | 179.5° | 180.0° |
| N11 | C12 | C13 | C14 | 178.2° | 179.5° |
| N11 | C12 | C7 | C6 | 178.4° | 180.0° |
| N11 | C12 | C13 | HC13 | 1.8° | 0.6° |
| C12 | N11 | C10 | HC10 | 179.7° | 180.0° |
| C9 | C8 | O18 | C7 | 174.8° | 180.0° |
| C9 | C8 | O18 | C19 | 5.1° | 5.7° |
| C9 | C8 | C7 | C12 | 1.7° | 0.3° |
| C9 | C8 | C7 | C6 | 176.8° | 180.0° |
| C8 | C9 | C10 | HC10 | 178.8° | 179.9° |
| C19 | C20 | C21 | H20B | 120.4° | 119.9° |
| C19 | C20 | C21 | H20A | 120.4° | 119.9° |
| C20 | C19 | O18 | C8 | 146.3° | 154.7° |
| C20 | C19 | O18 | C24 | 119.2° | 119.8° |
| C20 | C19 | O18 | HC19 | 119.6° | 120.1° |
| C20 | C19 | C24 | HC19 | 123.0° | 120.0° |
| C20 | C19 | C24 | N23 | 55.2° | 59.2° |
| C19 | C20 | C21 | C22 | 51.8° | 57.7° |
| C19 | C20 | H20B | H20A | 118.9° | 120.2° |
| C19 | C20 | C21 | H21B | 68.4° | 177.6° |
| C19 | C20 | C21 | H21A | 172.0° | 62.2° |
| C20 | C19 | C24 | H24B | 64.9° | 179.2° |
| C20 | C19 | C24 | H24A | 175.2° | 60.8° |
| C21 | C20 | C19 | O18 | 65.4° | 177.6° |
| C21 | C20 | C19 | C24 | 51.6° | 57.7° |
| C20 | C21 | C22 | H21B | 120.2° | 120.0° |
| C20 | C21 | C22 | H21A | 120.1° | 120.0° |
| C20 | C21 | C22 | N23 | 55.6° | 59.2° |
| C21 | C20 | H20B | H20A | 118.9° | 120.1° |
| C20 | C21 | H21B | H21A | 119.5° | 120.2° |
| C21 | C20 | C19 | HC19 | 174.5° | 62.3° |
| C20 | C21 | C22 | H22B | 175.7° | 60.8° |
| C20 | C21 | C22 | H22A | 64.4° | 179.2° |
| C8 | O18 | C19 | C24 | 94.6° | 85.5° |
| O18 | C8 | C7 | C12 | 173.5° | 179.7° |
| O18 | C8 | C7 | C6 | 8.0° | 0.0° |
| O18 | C8 | C9 | HC9 | 7.7° | 0.0° |
| C8 | O18 | C19 | HC19 | 26.7° | 34.6° |
| C7 | C8 | O18 | C19 | 179.9° | 174.3° |
| C8 | C7 | C12 | C13 | 179.7° | 179.7° |
| C8 | C7 | C12 | C6 | 178.6° | 179.7° |
| C8 | C7 | C6 | C5 | 177.5° | 180.0° |
| C8 | C7 | C6 | HC6 | 2.5° | 0.0° |
| C7 | C8 | C9 | HC9 | 177.8° | 180.0° |
| O18 | C19 | C24 | HC19 | 121.8° | 120.1° |
| O18 | C19 | C24 | N23 | 60.1° | 179.1° |
| O18 | C19 | C20 | H20B | 55.0° | 62.5° |
| O18 | C19 | C20 | H20A | 174.3° | 57.7° |
| O18 | C19 | C24 | H24B | 179.9° | 60.8° |
| O18 | C19 | C24 | H24A | 60.0° | 59.1° |
| C19 | C24 | N23 | H24B | 120.0° | 120.0° |
| C19 | C24 | N23 | H24A | 120.0° | 120.0° |
| C19 | C24 | N23 | C22 | 60.7° | 61.8° |
| C24 | C19 | C20 | H20B | 172.0° | 177.6° |
| C24 | C19 | C20 | H20A | 68.7° | 62.2° |
| C19 | C24 | N23 | HN23 | 179.0° | 62.3° |
| C19 | C24 | H24B | H24A | 119.9° | 119.9° |
| C12 | C13 | C14 | HC13 | 180.0° | 180.0° |
| C13 | C12 | C7 | C6 | 1.1° | 0.0° |
| C12 | C13 | C14 | C15 | 177.6° | 180.0° |
| C12 | C13 | C14 | C5 | 0.5° | 0.8° |
| C7 | C12 | C13 | C14 | 1.3° | 0.5° |
| C12 | C7 | C6 | C5 | 0.9° | 0.3° |
| C12 | C7 | C6 | HC6 | 179.1° | 179.7° |
| C7 | C12 | C13 | HC13 | 178.6° | 179.5° |
| C13 | C14 | C15 | O16 | 20.2° | 180.0° |
| C13 | C14 | C15 | C5 | 176.9° | 179.2° |
| C13 | C14 | C5 | C6 | 2.6° | 0.6° |
| C13 | C14 | C15 | N17 | 165.9° | 0.0° |
| C13 | C14 | C5 | O4 | 174.4° | 179.4° |
| C7 | C6 | C5 | C14 | 2.8° | 0.0° |
| C7 | C6 | C5 | HC6 | 180.0° | 179.9° |
| C7 | C6 | C5 | O4 | 173.9° | 180.0° |
| C24 | N23 | C22 | C21 | 61.5° | 61.8° |
| C24 | N23 | C22 | HN23 | 120.4° | 124.1° |
| N23 | C24 | C19 | HC19 | 178.2° | 60.8° |
| C24 | N23 | C22 | H22B | 178.4° | 58.2° |
| C24 | N23 | C22 | H22A | 58.6° | 178.3° |
| N23 | C24 | H24B | H24A | 119.9° | 120.0° |
| O16 | C15 | C14 | N17 | 173.9° | 180.0° |
| O16 | C15 | C14 | C5 | 162.8° | 0.8° |
| O16 | C15 | N17 | H17B | 0.0° | 180.0° |
| O16 | C15 | N17 | H17A | 180.0° | 0.0° |
| C21 | C22 | N23 | H22B | 120.1° | 120.0° |
| C21 | C22 | N23 | H22A | 120.1° | 120.0° |
| C22 | C21 | C20 | H20B | 172.2° | 177.6° |
| C22 | C21 | C20 | H20A | 68.6° | 62.3° |
| C22 | C21 | H21B | H21A | 119.5° | 120.0° |
| C21 | C22 | H22B | H22A | 119.8° | 119.9° |
| C21 | C22 | N23 | HN23 | 178.1° | 62.4° |
| C15 | C14 | C5 | C6 | 179.4° | 179.8° |
| C15 | C14 | C5 | O4 | 2.5° | 0.3° |
| C15 | C14 | C13 | HC13 | 2.4° | 0.0° |
| C14 | C15 | N17 | H17B | 173.8° | 0.1° |
| C14 | C15 | N17 | H17A | 6.2° | 180.0° |
| C14 | C5 | C6 | O4 | 176.6° | 180.0° |
| C5 | C14 | C15 | N17 | 11.1° | 179.1° |
| C14 | C5 | O4 | C2 | 173.5° | 175.0° |
| C14 | C5 | C6 | HC6 | 177.2° | 180.0° |
| C5 | C14 | C13 | HC13 | 179.6° | 179.1° |
| C6 | C5 | O4 | C2 | 3.3° | 5.0° |
| C15 | N17 | H17B | H17A | 180.0° | 179.9° |
| C5 | O4 | C2 | C3 | 91.6° | 155.3° |
| C5 | O4 | C2 | C1 | 146.9° | 84.6° |
| O4 | C5 | C6 | HC6 | 6.1° | 0.1° |
| C5 | O4 | C2 | HC2 | 28.4° | 35.3° |
| N23 | C22 | C21 | H21B | 64.6° | 179.1° |
| N23 | C22 | C21 | H21A | 175.8° | 60.8° |
| N23 | C22 | H22B | H22A | 119.7° | 120.0° |
| C22 | N23 | C24 | H24B | 59.3° | 178.3° |
| C22 | N23 | C24 | H24A | 179.3° | 58.3° |
| O4 | C2 | C3 | C1 | 118.0° | 120.0° |
| O4 | C2 | C3 | HC2 | 120.3° | 120.0° |
| O4 | C2 | C1 | HC2 | 118.7° | 120.0° |
| O4 | C2 | C1 | HC1B | 180.0° | 179.9° |
| O4 | C2 | C1 | HC1A | 60.0° | 60.0° |
| O4 | C2 | C1 | HC1C | 60.0° | 60.0° |
| O4 | C2 | C3 | HC3A | 180.0° | 60.0° |
| O4 | C2 | C3 | HC3C | 60.0° | 60.0° |
| O4 | C2 | C3 | HC3B | 60.0° | 180.0° |
| C3 | C2 | C1 | HC2 | 121.5° | 120.0° |
| C3 | C2 | C1 | HC1B | 60.2° | 60.0° |
| C3 | C2 | C1 | HC1A | 179.7° | 180.0° |
| C3 | C2 | C1 | HC1C | 59.7° | 60.0° |
| C2 | C3 | HC3A | HC3C | 120.0° | 120.0° |
| C2 | C3 | HC3A | HC3B | 120.0° | 120.0° |
| C2 | C3 | HC3C | HC3B | 120.0° | 120.1° |
| C2 | C1 | HC1B | HC1A | 120.0° | 120.0° |
| C2 | C1 | HC1B | HC1C | 120.0° | 120.0° |
| C2 | C1 | HC1A | HC1C | 120.0° | 119.9° |
| C1 | C2 | C3 | HC3A | 62.0° | 60.0° |
| C1 | C2 | C3 | HC3C | 58.0° | 180.0° |
| C1 | C2 | C3 | HC3B | 178.0° | 60.0° |
| HC9 | C9 | C10 | HC10 | 1.3° | 0.1° |
| H20B | C20 | C21 | H21B | 52.0° | 62.5° |
| H20B | C20 | C21 | H21A | 67.7° | 57.7° |
| H20B | C20 | C19 | HC19 | 65.1° | 57.6° |
| H20A | C20 | C21 | H21B | 171.2° | 57.6° |
| H20A | C20 | C21 | H21A | 51.6° | 177.8° |
| H20A | C20 | C19 | HC19 | 54.2° | 177.8° |
| H21B | C21 | C22 | H22B | 55.5° | 59.1° |
| H21B | C21 | C22 | H22A | 175.4° | 60.9° |
| H21A | C21 | C22 | H22B | 64.1° | 179.2° |
| H21A | C21 | C22 | H22A | 55.7° | 59.2° |
| HC19 | C19 | C24 | H24B | 58.1° | 59.2° |
| HC19 | C19 | C24 | H24A | 61.8° | 179.2° |
| HC1B | C1 | HC1A | HC1C | 120.0° | 120.1° |
| HC1B | C1 | C2 | HC2 | 61.3° | 60.0° |
| HC1A | C1 | C2 | HC2 | 58.8° | 60.0° |
| HC1C | C1 | C2 | HC2 | 178.7° | 179.9° |
| HC2 | C2 | C3 | HC3A | 59.7° | 180.0° |
| HC2 | C2 | C3 | HC3C | 179.7° | 60.0° |
| HC2 | C2 | C3 | HC3B | 60.3° | 60.0° |
| HC3A | C3 | HC3C | HC3B | 120.0° | 119.9° |
| H22B | C22 | N23 | HN23 | 58.0° | 177.6° |
| H22A | C22 | N23 | HN23 | 61.8° | 57.6° |
| HN23 | N23 | C24 | H24B | 61.0° | 57.6° |
| HN23 | N23 | C24 | H24A | 58.9° | 177.6° |
