14C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C13 | sing | 1.51Å | 1.51Å | |
| C10 | C8 | doub | 1.39Å | 1.50Å | Aromatic |
| C10 | C1 | sing | 1.39Å | 1.41Å | Aromatic |
| CL39 | C30 | sing | 1.74Å | 1.81Å | |
| C30 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | N32 | sing | 1.32Å | 1.36Å | Aromatic |
| C28 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| N32 | C34 | doub | 1.32Å | 1.34Å | Aromatic |
| C34 | C36 | sing | 1.38Å | 1.40Å | Aromatic |
| C36 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | N19 | sing | 1.40Å | 1.34Å | |
| N19 | C21 | sing | 1.34Å | 1.33Å | |
| N19 | C15 | sing | 1.35Å | 1.33Å | |
| C21 | O23 | doub | 1.21Å | 1.28Å | |
| C21 | C6 | sing | 1.48Å | 1.50Å | |
| C6 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C8 | sing | 1.41Å | 1.49Å | Aromatic |
| C4 | C2 | sing | 1.39Å | 1.42Å | Aromatic |
| C2 | C1 | doub | 1.38Å | 1.41Å | Aromatic |
| C15 | O17 | doub | 1.21Å | 1.28Å | |
| C15 | C8 | sing | 1.48Å | 1.48Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C10 | C8 | 121.6° | 120.1° |
| C13 | C10 | C1 | 121.0° | 120.2° |
| C10 | C13 | H13 | 109.5° | 109.5° |
| C10 | C13 | H13A | 109.5° | 109.4° |
| C10 | C13 | H13B | 109.5° | 109.5° |
| C8 | C10 | C1 | 117.4° | 119.7° |
| C10 | C8 | C6 | 119.8° | 119.8° |
| C10 | C8 | C15 | 138.6° | 134.3° |
| C10 | C1 | C2 | 120.7° | 120.5° |
| C10 | C1 | H1 | 119.6° | 119.8° |
| CL39 | C30 | C28 | 117.2° | 119.6° |
| CL39 | C30 | N32 | 123.5° | 119.6° |
| C28 | C30 | N32 | 119.3° | 120.8° |
| C30 | C28 | C26 | 123.5° | 119.1° |
| C30 | C28 | H28 | 118.3° | 120.4° |
| C30 | N32 | C34 | 120.3° | 121.9° |
| C28 | C26 | C36 | 114.5° | 118.3° |
| C28 | C26 | N19 | 118.9° | 120.8° |
| C26 | C28 | H28 | 118.3° | 120.5° |
| N32 | C34 | C36 | 120.3° | 120.9° |
| N32 | C34 | H34 | 119.8° | 119.6° |
| C34 | C36 | C26 | 122.1° | 119.2° |
| C36 | C34 | H34 | 119.9° | 119.6° |
| C34 | C36 | H36 | 118.9° | 120.5° |
| C36 | C26 | N19 | 126.6° | 120.9° |
| C26 | C36 | H36 | 118.9° | 120.4° |
| C26 | N19 | C21 | 129.4° | 124.5° |
| C26 | N19 | C15 | 120.9° | 124.4° |
| C21 | N19 | C15 | 109.6° | 111.1° |
| N19 | C21 | O23 | 123.8° | 125.7° |
| N19 | C21 | C6 | 110.4° | 108.6° |
| N19 | C15 | O17 | 123.1° | 125.7° |
| N19 | C15 | C8 | 113.6° | 108.6° |
| O23 | C21 | C6 | 125.8° | 125.7° |
| C21 | C6 | C4 | 136.2° | 134.3° |
| C21 | C6 | C8 | 104.8° | 105.9° |
| C4 | C6 | C8 | 119.0° | 119.8° |
| C6 | C4 | C2 | 119.5° | 119.8° |
| C6 | C4 | H4 | 120.2° | 120.1° |
| C6 | C8 | C15 | 101.5° | 105.8° |
| C4 | C2 | C1 | 123.6° | 120.5° |
| C2 | C4 | H4 | 120.3° | 120.1° |
| C4 | C2 | H2 | 118.2° | 119.8° |
| C1 | C2 | H2 | 118.2° | 119.7° |
| C2 | C1 | H1 | 119.7° | 119.8° |
| O17 | C15 | C8 | 123.2° | 125.7° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| H13 | C13 | H13B | 109.5° | 109.5° |
| H13A | C13 | H13B | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C10 | C8 | C1 | 179.5° | 179.7° |
| C13 | C10 | C8 | C6 | 179.6° | 180.0° |
| C13 | C10 | C1 | C2 | 179.5° | 180.0° |
| C13 | C10 | C8 | C15 | 0.8° | 0.0° |
| C10 | C13 | H13 | H13A | 120.0° | 120.0° |
| C10 | C13 | H13 | H13B | 120.0° | 120.0° |
| C10 | C13 | H13A | H13B | 120.0° | 120.0° |
| C13 | C10 | C1 | H1 | 0.5° | 0.0° |
| C10 | C8 | C15 | N19 | 178.6° | 180.0° |
| C10 | C8 | C6 | C21 | 179.9° | 180.0° |
| C10 | C8 | C6 | C4 | 0.1° | 0.1° |
| C10 | C8 | C6 | C15 | 179.7° | 180.0° |
| C8 | C10 | C1 | C2 | 0.0° | 0.3° |
| C10 | C8 | C15 | O17 | 0.6° | 0.0° |
| C8 | C10 | C13 | H13 | 91.1° | 90.0° |
| C8 | C10 | C13 | H13A | 28.9° | 150.0° |
| C8 | C10 | C13 | H13B | 148.9° | 30.0° |
| C8 | C10 | C1 | H1 | 180.0° | 179.8° |
| C1 | C10 | C8 | C6 | 0.2° | 0.3° |
| C10 | C1 | C2 | C4 | 0.3° | 0.1° |
| C10 | C1 | C2 | H1 | 180.0° | 180.0° |
| C1 | C10 | C8 | C15 | 179.7° | 179.7° |
| C1 | C10 | C13 | H13 | 88.4° | 90.3° |
| C1 | C10 | C13 | H13A | 151.6° | 29.7° |
| C1 | C10 | C13 | H13B | 31.6° | 149.7° |
| C10 | C1 | C2 | H2 | 179.7° | 179.7° |
| CL39 | C30 | C28 | N32 | 179.3° | 179.7° |
| CL39 | C30 | C28 | C26 | 179.1° | 180.0° |
| CL39 | C30 | N32 | C34 | 179.8° | 180.0° |
| CL39 | C30 | C28 | H28 | 0.9° | 0.1° |
| C30 | C28 | C26 | H28 | 180.0° | 179.9° |
| C28 | C30 | N32 | C34 | 0.5° | 0.3° |
| C30 | C28 | C26 | C36 | 0.8° | 0.0° |
| C30 | C28 | C26 | N19 | 178.4° | 180.0° |
| N32 | C30 | C28 | C26 | 0.2° | 0.3° |
| C30 | N32 | C34 | C36 | 0.5° | 0.0° |
| N32 | C30 | C28 | H28 | 179.8° | 179.8° |
| C30 | N32 | C34 | H34 | 179.5° | 180.0° |
| C28 | C26 | C36 | C34 | 0.8° | 0.3° |
| C28 | C26 | C36 | N19 | 177.4° | 180.0° |
| C28 | C26 | N19 | C21 | 100.0° | 0.0° |
| C28 | C26 | N19 | C15 | 75.0° | 179.9° |
| C28 | C26 | C36 | H36 | 179.2° | 179.9° |
| N32 | C34 | C36 | H34 | 180.0° | 180.0° |
| N32 | C34 | C36 | C26 | 0.2° | 0.3° |
| N32 | C34 | C36 | H36 | 179.8° | 179.9° |
| C34 | C36 | C26 | H36 | 180.0° | 179.7° |
| C34 | C36 | C26 | N19 | 178.2° | 179.7° |
| C36 | C26 | N19 | C21 | 82.7° | 180.0° |
| C36 | C26 | N19 | C15 | 102.3° | 0.1° |
| C36 | C26 | C28 | H28 | 179.2° | 179.9° |
| C26 | C36 | C34 | H34 | 179.8° | 179.7° |
| C26 | N19 | C21 | C15 | 175.4° | 180.0° |
| C26 | N19 | C21 | O23 | 4.0° | 0.1° |
| C26 | N19 | C21 | C6 | 177.5° | 180.0° |
| C26 | N19 | C15 | O17 | 2.9° | 0.1° |
| C26 | N19 | C15 | C8 | 177.9° | 180.0° |
| N19 | C26 | C28 | H28 | 1.6° | 0.1° |
| N19 | C26 | C36 | H36 | 1.8° | 0.1° |
| N19 | C21 | O23 | C6 | 178.4° | 179.9° |
| N19 | C21 | C6 | C4 | 178.6° | 179.9° |
| N19 | C21 | C6 | C8 | 1.4° | 0.0° |
| C21 | N19 | C15 | O17 | 178.8° | 180.0° |
| C21 | N19 | C15 | C8 | 2.0° | 0.0° |
| C15 | N19 | C21 | O23 | 179.4° | 180.0° |
| C15 | N19 | C21 | C6 | 2.1° | 0.0° |
| N19 | C15 | C8 | C6 | 1.0° | 0.0° |
| N19 | C15 | O17 | C8 | 179.2° | 179.9° |
| O23 | C21 | C6 | C4 | 0.1° | 0.1° |
| O23 | C21 | C6 | C8 | 179.9° | 180.0° |
| C21 | C6 | C4 | C8 | 180.0° | 179.9° |
| C21 | C6 | C4 | C2 | 179.8° | 179.6° |
| C21 | C6 | C8 | C15 | 0.2° | 0.0° |
| C21 | C6 | C4 | H4 | 0.2° | 0.1° |
| C6 | C4 | C2 | H4 | 180.0° | 179.5° |
| C6 | C4 | C2 | C1 | 0.4° | 0.5° |
| C4 | C6 | C8 | C15 | 179.8° | 179.9° |
| C6 | C4 | C2 | H2 | 179.6° | 180.0° |
| C8 | C6 | C4 | C2 | 0.2° | 0.5° |
| C6 | C8 | C15 | O17 | 179.7° | 180.0° |
| C8 | C6 | C4 | H4 | 179.8° | 180.0° |
| C4 | C2 | C1 | H2 | 180.0° | 179.6° |
| C4 | C2 | C1 | H1 | 179.7° | 179.9° |
| C1 | C2 | C4 | H4 | 179.6° | 180.0° |
| H13 | C13 | H13A | H13B | 120.0° | 120.0° |
| H34 | C34 | C36 | H36 | 0.2° | 0.0° |
| H4 | C4 | C2 | H2 | 0.4° | 0.4° |
| H2 | C2 | C1 | H1 | 0.3° | 0.3° |
