RVC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OB' | C' | doub | 1.21Å | 1.25Å | |
| OB | C | sing | 1.35Å | 1.25Å | |
| OA' | C' | sing | 1.35Å | 1.25Å | |
| OA | C | doub | 1.22Å | 1.25Å | |
| O2 | C2 | sing | 1.36Å | 1.36Å | |
| C8 | C7 | doub | 1.33Å | 1.53Å | |
| C8 | C9 | sing | 1.51Å | 1.53Å | |
| C5 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C1 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | C9 | sing | 1.53Å | 1.52Å | |
| C11 | C9 | sing | 1.53Å | 1.52Å | |
| O3 | C7 | sing | 1.36Å | 1.36Å | |
| O3 | C3 | sing | 1.36Å | 1.36Å | |
| C' | C7 | sing | 1.47Å | 1.53Å | |
| C | C1 | sing | 1.47Å | 1.39Å | |
| C2 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| OB | HOB | sing | 0.97Å | 0.95Å | |
| OA' | HOA' | sing | 0.97Å | 0.95Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OB' | C' | OA' | 120.0° | 120.0° |
| OB' | C' | C7 | 120.0° | 120.0° |
| OB | C | OA | 119.9° | 120.0° |
| OB | C | C1 | 120.0° | 120.0° |
| C | OB | HOB | 109.5° | 117.0° |
| OA' | C' | C7 | 120.0° | 120.0° |
| C' | OA' | HOA' | 109.5° | 117.0° |
| OA | C | C1 | 120.1° | 120.0° |
| O2 | C2 | C3 | 119.1° | 120.2° |
| O2 | C2 | C1 | 119.1° | 120.2° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| C7 | C8 | C9 | 115.0° | 120.0° |
| C8 | C7 | O3 | 115.0° | 120.0° |
| C8 | C7 | C' | 115.0° | 120.0° |
| C7 | C8 | H8 | 122.5° | 120.0° |
| C8 | C9 | C10 | 115.0° | 117.5° |
| C8 | C9 | C11 | 115.0° | 117.5° |
| C9 | C8 | H8 | 122.5° | 120.0° |
| C8 | C9 | H9 | 117.9° | 115.6° |
| C4 | C5 | C6 | 120.9° | 120.3° |
| C5 | C4 | C3 | 118.9° | 120.3° |
| C4 | C5 | H5 | 119.5° | 119.8° |
| C5 | C4 | H4 | 120.5° | 119.8° |
| C5 | C6 | C1 | 120.1° | 120.1° |
| C6 | C5 | H5 | 119.5° | 119.8° |
| C5 | C6 | H6 | 120.0° | 120.0° |
| C4 | C3 | O3 | 123.1° | 120.0° |
| C4 | C3 | C2 | 119.8° | 120.0° |
| C3 | C4 | H4 | 120.6° | 119.8° |
| C6 | C1 | C | 120.8° | 120.2° |
| C6 | C1 | C2 | 118.5° | 119.6° |
| C1 | C6 | H6 | 120.0° | 119.9° |
| C11 | C10 | C9 | 60.0° | 60.0° |
| C10 | C11 | C9 | 60.0° | 60.0° |
| C11 | C10 | H10 | 120.0° | 117.5° |
| C11 | C10 | H10A | 120.0° | 117.5° |
| C10 | C11 | H11 | 120.0° | 117.5° |
| C10 | C11 | H11A | 120.0° | 117.5° |
| C10 | C9 | C11 | 60.0° | 60.0° |
| C9 | C10 | H10 | 120.0° | 117.5° |
| C9 | C10 | H10A | 120.0° | 117.5° |
| C10 | C9 | H9 | 118.1° | 117.5° |
| C9 | C11 | H11 | 120.0° | 117.5° |
| C9 | C11 | H11A | 120.0° | 117.5° |
| C11 | C9 | H9 | 118.1° | 117.5° |
| C7 | O3 | C3 | 109.4° | 117.9° |
| O3 | C7 | C' | 115.0° | 120.0° |
| O3 | C3 | C2 | 117.1° | 120.0° |
| C | C1 | C2 | 120.7° | 120.1° |
| C3 | C2 | C1 | 121.8° | 119.6° |
| H10 | C10 | H10A | 109.5° | 115.6° |
| H11 | C11 | H11A | 109.5° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OB' | C' | OA' | C7 | 180.0° | 180.0° |
| OB' | C' | C7 | C8 | 103.1° | 180.0° |
| OB' | C' | C7 | O3 | 119.9° | 0.1° |
| OB' | C' | OA' | HOA' | 0.0° | 0.0° |
| OB | C | OA | C1 | 179.9° | 180.0° |
| OB | C | C1 | C6 | 10.8° | 0.0° |
| OB | C | C1 | C2 | 169.3° | 180.0° |
| OA' | C' | C7 | C8 | 76.9° | 0.1° |
| OA' | C' | C7 | O3 | 60.2° | 180.0° |
| OA | C | C1 | C6 | 169.3° | 180.0° |
| OA | C | C1 | C2 | 10.6° | 0.0° |
| OA | C | OB | HOB | 0.0° | 0.0° |
| O2 | C2 | C3 | C4 | 180.0° | 180.0° |
| O2 | C2 | C1 | C6 | 180.0° | 180.0° |
| O2 | C2 | C3 | O3 | 0.0° | 0.0° |
| O2 | C2 | C1 | C | 0.0° | 0.0° |
| O2 | C2 | C3 | C1 | 180.0° | 180.0° |
| C7 | C8 | C9 | H8 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 144.8° | 114.9° |
| C7 | C8 | C9 | C11 | 148.2° | 176.5° |
| C8 | C7 | O3 | C' | 137.0° | 179.9° |
| C8 | C7 | O3 | C3 | 136.4° | 113.2° |
| C7 | C8 | C9 | H9 | 1.7° | 30.7° |
| C8 | C9 | C11 | C10 | 105.6° | 107.5° |
| C8 | C9 | C10 | H9 | 146.4° | 145.0° |
| C8 | C9 | C11 | H9 | 146.4° | 145.1° |
| C9 | C8 | C7 | O3 | 0.1° | 5.1° |
| C9 | C8 | C7 | C' | 137.1° | 175.0° |
| C8 | C9 | C10 | H10 | 144.9° | 145.0° |
| C8 | C9 | C10 | H10A | 3.9° | 0.0° |
| C8 | C9 | C11 | H11 | 3.8° | 0.1° |
| C8 | C9 | C11 | H11A | 144.9° | 145.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.8° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C4 | C5 | C6 | C1 | 0.1° | 0.1° |
| C5 | C4 | C3 | O3 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.0° | 0.0° |
| C4 | C5 | C6 | H6 | 179.9° | 180.0° |
| C6 | C5 | C4 | C3 | 0.1° | 0.0° |
| C5 | C6 | C1 | H6 | 180.0° | 180.0° |
| C5 | C6 | C1 | C | 179.9° | 180.0° |
| C5 | C6 | C1 | C2 | 0.0° | 0.1° |
| C6 | C5 | C4 | H4 | 179.9° | 180.0° |
| C4 | C3 | O3 | C7 | 16.1° | 5.6° |
| C4 | C3 | O3 | C2 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.0° | 0.0° |
| C3 | C4 | C5 | H5 | 180.0° | 179.7° |
| C6 | C1 | C | C2 | 179.9° | 180.0° |
| C6 | C1 | C2 | C3 | 0.0° | 0.0° |
| C1 | C6 | C5 | H5 | 180.0° | 179.7° |
| C11 | C10 | C9 | H10 | 109.5° | 107.5° |
| C11 | C10 | C9 | H10A | 109.5° | 107.5° |
| C10 | C11 | C9 | H11 | 109.5° | 107.6° |
| C10 | C11 | C9 | H11A | 109.5° | 107.5° |
| C11 | C10 | H10 | H10A | 144.8° | 145.7° |
| C10 | C11 | H11 | H11A | 144.7° | 145.7° |
| C11 | C10 | C9 | H9 | 108.0° | 107.5° |
| C10 | C9 | C8 | H8 | 35.2° | 65.1° |
| C9 | C10 | H10 | H10A | 144.7° | 145.7° |
| C11 | C9 | C8 | H8 | 31.8° | 3.5° |
| C9 | C11 | H11 | H11A | 144.7° | 145.7° |
| C7 | O3 | C3 | C2 | 163.9° | 174.4° |
| O3 | C7 | C8 | H8 | 179.9° | 174.9° |
| C3 | O3 | C7 | C' | 86.6° | 66.8° |
| O3 | C3 | C2 | C1 | 180.0° | 180.0° |
| O3 | C3 | C4 | H4 | 0.0° | 0.0° |
| C7 | C' | OA' | HOA' | 179.9° | 180.0° |
| C' | C7 | C8 | H8 | 42.9° | 5.0° |
| C | C1 | C2 | C3 | 179.9° | 180.0° |
| C1 | C | OB | HOB | 179.9° | 180.0° |
| C | C1 | C6 | H6 | 0.1° | 0.0° |
| C3 | C2 | O2 | HO2 | 175.3° | 90.0° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| C1 | C2 | O2 | HO2 | 4.7° | 90.0° |
| C2 | C1 | C6 | H6 | 180.0° | 180.0° |
| H8 | C8 | C9 | H9 | 178.3° | 149.3° |
| H5 | C5 | C4 | H4 | 0.1° | 0.3° |
| H5 | C5 | C6 | H6 | 0.0° | 0.3° |
| H10 | C10 | C11 | H11 | 141.1° | 145.0° |
| H10 | C10 | C11 | H11A | 0.0° | 0.0° |
| H10 | C10 | C9 | H9 | 1.5° | 0.0° |
| H10A | C10 | C11 | H11 | 0.0° | 0.0° |
| H10A | C10 | C11 | H11A | 141.1° | 145.0° |
| H10A | C10 | C9 | H9 | 142.5° | 145.0° |
| H11 | C11 | C9 | H9 | 142.6° | 145.0° |
| H11A | C11 | C9 | H9 | 1.5° | 0.1° |
