X2I
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CBD | CAD | doub | 1.33Å | 1.31Å | |
| CAD | C3D | sing | 1.48Å | 1.52Å | |
| OD | C4D | doub | 1.22Å | 1.25Å | |
| C3D | C4D | sing | 1.47Å | 1.45Å | |
| C3D | C2D | doub | 1.34Å | 1.33Å | |
| C4D | ND | sing | 1.35Å | 1.39Å | |
| C2D | CMD | sing | 1.51Å | 1.50Å | |
| C2D | C1D | sing | 1.51Å | 1.52Å | |
| CMC | C3C | sing | 1.51Å | 1.53Å | |
| ND | C1D | sing | 1.47Å | 1.44Å | |
| CHC | C1D | sing | 1.53Å | 1.48Å | |
| CHC | C4C | sing | 1.51Å | 1.49Å | |
| C3C | C4C | doub | 1.35Å | 1.37Å | Aromatic |
| C3C | C2C | sing | 1.41Å | 1.39Å | Aromatic |
| C4C | NC | sing | 1.36Å | 1.36Å | Aromatic |
| O2C | CGC | doub | 1.21Å | 1.25Å | |
| C2C | CAC | sing | 1.51Å | 1.51Å | |
| C2C | C1C | doub | 1.35Å | 1.38Å | Aromatic |
| CGC | CBC | sing | 1.51Å | 1.53Å | |
| CGC | O1C | sing | 1.34Å | 1.26Å | |
| CBC | CAC | sing | 1.53Å | 1.51Å | |
| NC | C1C | sing | 1.36Å | 1.38Å | Aromatic |
| C1C | CHB | sing | 1.51Å | 1.37Å | |
| CHB | C4B | sing | 1.51Å | 1.52Å | |
| NB | C4B | sing | 1.36Å | 1.36Å | Aromatic |
| NB | C1B | sing | 1.38Å | 1.37Å | Aromatic |
| C4B | C3B | doub | 1.36Å | 1.38Å | Aromatic |
| CBA | CAA | sing | 1.53Å | 1.52Å | |
| O1B | CGB | doub | 1.21Å | 1.26Å | |
| C1B | CHA | sing | 1.41Å | 1.51Å | |
| C1B | C2B | doub | 1.39Å | 1.37Å | Aromatic |
| CHA | C4A | doub | 1.38Å | 1.36Å | |
| C3B | CAB | sing | 1.51Å | 1.50Å | |
| C3B | C2B | sing | 1.40Å | 1.37Å | Aromatic |
| CAA | C3A | sing | 1.51Å | 1.51Å | |
| CAB | CBB | sing | 1.53Å | 1.52Å | |
| C2B | CMB | sing | 1.51Å | 1.50Å | |
| CGB | CBB | sing | 1.51Å | 1.50Å | |
| CGB | O2B | sing | 1.34Å | 1.27Å | |
| C4A | C3A | sing | 1.41Å | 1.41Å | |
| C4A | NA | sing | 1.39Å | 1.36Å | |
| C3A | C2A | doub | 1.36Å | 1.36Å | |
| NA | C1A | sing | 1.35Å | 1.35Å | |
| C2A | CMA | sing | 1.51Å | 1.51Å | |
| C2A | C1A | sing | 1.41Å | 1.38Å | |
| C1A | OA | doub | 1.22Å | 1.24Å | |
| NA | HNA | sing | 0.97Å | 1.00Å | |
| CMA | HMA2 | sing | 1.09Å | 1.10Å | |
| CMA | HMA1 | sing | 1.09Å | 1.10Å | |
| CMA | HMA3 | sing | 1.09Å | 1.10Å | |
| CBA | HBA1 | sing | 1.09Å | 1.10Å | |
| CBA | HBA2 | sing | 1.09Å | 1.10Å | |
| CBA | HBA3 | sing | 1.09Å | 1.10Å | |
| CHA | HHA1 | sing | 1.08Å | 1.08Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | H1 | sing | 1.09Å | 1.10Å | |
| NB | HNB | sing | 0.97Å | 1.00Å | |
| CHB | HHB1 | sing | 1.09Å | 1.10Å | |
| CHB | H2 | sing | 1.09Å | 1.10Å | |
| CMB | HMB1 | sing | 1.09Å | 1.10Å | |
| CMB | HMB2 | sing | 1.09Å | 1.10Å | |
| CMB | HMB3 | sing | 1.09Å | 1.10Å | |
| CAB | HAB1 | sing | 1.09Å | 1.10Å | |
| CAB | HAB2 | sing | 1.09Å | 1.10Å | |
| CBB | HBB2 | sing | 1.09Å | 1.10Å | |
| CBB | HBB1 | sing | 1.09Å | 1.10Å | |
| O2B | H3 | sing | 0.97Å | 0.95Å | |
| CHC | HHC2 | sing | 1.09Å | 1.10Å | |
| CHC | HHC1 | sing | 1.09Å | 1.10Å | |
| NC | H4 | sing | 0.97Å | 1.00Å | |
| CMC | HMC1 | sing | 1.09Å | 1.10Å | |
| CMC | HMC3 | sing | 1.09Å | 1.10Å | |
| CMC | HMC2 | sing | 1.09Å | 1.10Å | |
| CAC | HAC2 | sing | 1.09Å | 1.10Å | |
| CAC | HAC1 | sing | 1.09Å | 1.10Å | |
| CBC | HBC2 | sing | 1.09Å | 1.10Å | |
| CBC | HBC1 | sing | 1.09Å | 1.10Å | |
| O1C | H5 | sing | 0.97Å | 0.95Å | |
| ND | HND | sing | 0.97Å | 1.00Å | |
| C1D | H1D1 | sing | 1.09Å | 1.10Å | |
| CMD | HMD2 | sing | 1.09Å | 1.10Å | |
| CMD | HMD1 | sing | 1.09Å | 1.10Å | |
| CMD | HMD3 | sing | 1.09Å | 1.10Å | |
| CAD | HAD1 | sing | 1.08Å | 1.08Å | |
| CBD | HBD2 | sing | 1.08Å | 1.08Å | |
| CBD | HBD1 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CBD | CAD | C3D | 122.5° | 120.1° |
| CBD | CAD | HAD1 | 118.7° | 120.0° |
| CAD | CBD | HBD2 | 120.0° | 120.0° |
| CAD | CBD | HBD1 | 120.0° | 120.1° |
| CAD | C3D | C4D | 133.3° | 125.3° |
| CAD | C3D | C2D | 118.5° | 125.3° |
| C3D | CAD | HAD1 | 118.7° | 120.0° |
| OD | C4D | C3D | 133.3° | 125.1° |
| OD | C4D | ND | 119.4° | 125.0° |
| C4D | C3D | C2D | 108.2° | 109.4° |
| C3D | C4D | ND | 107.3° | 110.0° |
| C3D | C2D | CMD | 125.2° | 126.6° |
| C3D | C2D | C1D | 111.5° | 106.9° |
| C4D | ND | C1D | 111.7° | 107.6° |
| C4D | ND | HND | 124.2° | 126.2° |
| CMD | C2D | C1D | 123.2° | 126.6° |
| C2D | CMD | HMD2 | 109.5° | 109.5° |
| C2D | CMD | HMD1 | 109.5° | 109.5° |
| C2D | CMD | HMD3 | 109.4° | 109.4° |
| C2D | C1D | ND | 101.2° | 106.1° |
| C2D | C1D | CHC | 110.0° | 110.1° |
| C2D | C1D | H1D1 | 110.1° | 110.2° |
| CMC | C3C | C4C | 124.8° | 126.3° |
| CMC | C3C | C2C | 127.2° | 126.3° |
| C3C | CMC | HMC1 | 109.5° | 109.5° |
| C3C | CMC | HMC3 | 109.5° | 109.4° |
| C3C | CMC | HMC2 | 109.5° | 109.5° |
| ND | C1D | CHC | 113.2° | 110.1° |
| C1D | ND | HND | 124.2° | 126.2° |
| ND | C1D | H1D1 | 111.3° | 110.1° |
| C1D | CHC | C4C | 110.3° | 109.5° |
| C1D | CHC | HHC2 | 109.3° | 109.5° |
| C1D | CHC | HHC1 | 109.3° | 109.5° |
| CHC | C1D | H1D1 | 110.7° | 110.1° |
| CHC | C4C | C3C | 128.1° | 125.9° |
| CHC | C4C | NC | 124.1° | 125.9° |
| C4C | CHC | HHC2 | 109.3° | 109.5° |
| C4C | CHC | HHC1 | 109.3° | 109.5° |
| C4C | C3C | C2C | 108.0° | 107.4° |
| C3C | C4C | NC | 107.8° | 108.2° |
| C3C | C2C | CAC | 125.9° | 126.3° |
| C3C | C2C | C1C | 108.1° | 107.5° |
| C4C | NC | C1C | 109.3° | 108.7° |
| C4C | NC | H4 | 125.3° | 125.7° |
| O2C | CGC | CBC | 121.3° | 120.0° |
| O2C | CGC | O1C | 119.8° | 119.9° |
| CAC | C2C | C1C | 126.0° | 126.3° |
| C2C | CAC | CBC | 112.3° | 109.4° |
| C2C | CAC | HAC2 | 108.8° | 109.5° |
| C2C | CAC | HAC1 | 108.8° | 109.5° |
| C2C | C1C | NC | 106.8° | 108.2° |
| C2C | C1C | CHB | 125.1° | 125.9° |
| CBC | CGC | O1C | 118.8° | 120.0° |
| CGC | CBC | CAC | 107.4° | 109.4° |
| CGC | CBC | HBC2 | 110.0° | 109.5° |
| CGC | CBC | HBC1 | 110.0° | 109.5° |
| CGC | O1C | H5 | 109.5° | 117.0° |
| CBC | CAC | HAC2 | 108.7° | 109.5° |
| CBC | CAC | HAC1 | 108.8° | 109.5° |
| CAC | CBC | HBC2 | 110.0° | 109.5° |
| CAC | CBC | HBC1 | 110.0° | 109.5° |
| NC | C1C | CHB | 128.0° | 125.9° |
| C1C | NC | H4 | 125.4° | 125.6° |
| C1C | CHB | C4B | 127.5° | 109.5° |
| C1C | CHB | HHB1 | 104.8° | 109.4° |
| C1C | CHB | H2 | 104.8° | 109.5° |
| CHB | C4B | NB | 126.8° | 125.5° |
| CHB | C4B | C3B | 125.7° | 125.5° |
| C4B | CHB | HHB1 | 104.8° | 109.5° |
| C4B | CHB | H2 | 104.8° | 109.5° |
| C4B | NB | C1B | 109.1° | 108.6° |
| NB | C4B | C3B | 107.5° | 109.0° |
| C4B | NB | HNB | 125.5° | 125.7° |
| NB | C1B | CHA | 119.7° | 126.3° |
| NB | C1B | C2B | 107.4° | 107.4° |
| C1B | NB | HNB | 125.5° | 125.7° |
| C4B | C3B | CAB | 124.9° | 126.0° |
| C4B | C3B | C2B | 108.0° | 108.0° |
| CBA | CAA | C3A | 112.9° | 109.4° |
| CAA | CBA | HBA1 | 109.5° | 109.5° |
| CAA | CBA | HBA2 | 109.5° | 109.5° |
| CAA | CBA | HBA3 | 109.5° | 109.5° |
| CBA | CAA | HAA1 | 108.6° | 109.5° |
| CBA | CAA | H1 | 108.6° | 109.5° |
| O1B | CGB | CBB | 120.7° | 120.0° |
| O1B | CGB | O2B | 121.9° | 120.0° |
| CHA | C1B | C2B | 132.8° | 126.3° |
| C1B | CHA | C4A | 129.7° | 120.0° |
| C1B | CHA | HHA1 | 115.2° | 120.0° |
| C1B | C2B | C3B | 108.1° | 107.1° |
| C1B | C2B | CMB | 128.9° | 126.5° |
| CHA | C4A | C3A | 126.7° | 126.2° |
| CHA | C4A | NA | 125.8° | 126.2° |
| C4A | CHA | HHA1 | 115.1° | 120.0° |
| CAB | C3B | C2B | 127.0° | 126.0° |
| C3B | CAB | CBB | 115.4° | 109.4° |
| C3B | CAB | HAB1 | 108.0° | 109.5° |
| C3B | CAB | HAB2 | 108.0° | 109.5° |
| C3B | C2B | CMB | 123.1° | 126.5° |
| CAA | C3A | C4A | 129.0° | 126.3° |
| CAA | C3A | C2A | 124.0° | 126.2° |
| C3A | CAA | HAA1 | 108.6° | 109.4° |
| C3A | CAA | H1 | 108.6° | 109.4° |
| CAB | CBB | CGB | 112.8° | 109.5° |
| CBB | CAB | HAB1 | 107.9° | 109.5° |
| CBB | CAB | HAB2 | 107.9° | 109.4° |
| CAB | CBB | HBB2 | 108.6° | 109.5° |
| CAB | CBB | HBB1 | 108.7° | 109.4° |
| C2B | CMB | HMB1 | 109.5° | 109.4° |
| C2B | CMB | HMB2 | 109.5° | 109.5° |
| C2B | CMB | HMB3 | 109.4° | 109.5° |
| CBB | CGB | O2B | 117.4° | 119.9° |
| CGB | CBB | HBB2 | 108.6° | 109.5° |
| CGB | CBB | HBB1 | 108.6° | 109.5° |
| CGB | O2B | H3 | 109.5° | 117.0° |
| C3A | C4A | NA | 107.5° | 107.6° |
| C4A | C3A | C2A | 107.0° | 107.5° |
| C4A | NA | C1A | 108.9° | 108.3° |
| C4A | NA | HNA | 125.5° | 125.9° |
| C3A | C2A | CMA | 126.4° | 126.0° |
| C3A | C2A | C1A | 108.3° | 108.1° |
| NA | C1A | C2A | 108.3° | 108.6° |
| NA | C1A | OA | 122.8° | 125.7° |
| C1A | NA | HNA | 125.5° | 125.8° |
| CMA | C2A | C1A | 125.3° | 125.9° |
| C2A | CMA | HMA2 | 109.5° | 109.5° |
| C2A | CMA | HMA1 | 109.4° | 109.4° |
| C2A | CMA | HMA3 | 109.4° | 109.5° |
| C2A | C1A | OA | 128.9° | 125.7° |
| HMA2 | CMA | HMA1 | 109.5° | 109.4° |
| HMA2 | CMA | HMA3 | 109.5° | 109.5° |
| HMA1 | CMA | HMA3 | 109.5° | 109.5° |
| HBA1 | CBA | HBA2 | 109.5° | 109.5° |
| HBA1 | CBA | HBA3 | 109.4° | 109.5° |
| HBA2 | CBA | HBA3 | 109.5° | 109.5° |
| HAA1 | CAA | H1 | 109.5° | 109.5° |
| HHB1 | CHB | H2 | 109.4° | 109.5° |
| HMB1 | CMB | HMB2 | 109.5° | 109.4° |
| HMB1 | CMB | HMB3 | 109.5° | 109.5° |
| HMB2 | CMB | HMB3 | 109.5° | 109.5° |
| HAB1 | CAB | HAB2 | 109.5° | 109.4° |
| HBB2 | CBB | HBB1 | 109.4° | 109.5° |
| HHC2 | CHC | HHC1 | 109.4° | 109.4° |
| HMC1 | CMC | HMC3 | 109.5° | 109.5° |
| HMC1 | CMC | HMC2 | 109.5° | 109.5° |
| HMC3 | CMC | HMC2 | 109.4° | 109.5° |
| HAC2 | CAC | HAC1 | 109.5° | 109.5° |
| HBC2 | CBC | HBC1 | 109.4° | 109.5° |
| HMD2 | CMD | HMD1 | 109.4° | 109.5° |
| HMD2 | CMD | HMD3 | 109.5° | 109.4° |
| HMD1 | CMD | HMD3 | 109.5° | 109.5° |
| HBD2 | CBD | HBD1 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CBD | CAD | C3D | HAD1 | 180.0° | 179.9° |
| CBD | CAD | C3D | C4D | 10.2° | 0.1° |
| CBD | CAD | C3D | C2D | 170.0° | 179.5° |
| CAD | CBD | HBD2 | HBD1 | 180.0° | 179.8° |
| CAD | C3D | C4D | OD | 2.0° | 0.4° |
| CAD | C3D | C4D | C2D | 179.9° | 179.6° |
| CAD | C3D | C4D | ND | 178.1° | 180.0° |
| CAD | C3D | C2D | CMD | 1.5° | 0.1° |
| CAD | C3D | C2D | C1D | 177.4° | 179.9° |
| C3D | CAD | CBD | HBD2 | 180.0° | 0.1° |
| C3D | CAD | CBD | HBD1 | 0.0° | 180.0° |
| OD | C4D | C3D | ND | 179.9° | 179.6° |
| OD | C4D | C3D | C2D | 177.9° | 180.0° |
| OD | C4D | ND | C1D | 179.4° | 180.0° |
| OD | C4D | ND | HND | 0.6° | 0.3° |
| C4D | C3D | C2D | CMD | 178.4° | 179.8° |
| C4D | C3D | C2D | C1D | 2.7° | 0.2° |
| C3D | C4D | ND | C1D | 0.5° | 0.4° |
| C3D | C4D | ND | HND | 179.5° | 179.9° |
| C4D | C3D | CAD | HAD1 | 169.8° | 180.0° |
| C2D | C3D | C4D | ND | 2.0° | 0.4° |
| C3D | C2D | CMD | C1D | 178.7° | 180.0° |
| C3D | C2D | C1D | ND | 2.3° | 0.0° |
| C3D | C2D | C1D | CHC | 117.6° | 119.2° |
| C3D | C2D | C1D | H1D1 | 120.2° | 119.2° |
| C3D | C2D | CMD | HMD2 | 180.0° | 90.1° |
| C3D | C2D | CMD | HMD1 | 60.0° | 30.0° |
| C3D | C2D | CMD | HMD3 | 60.0° | 150.0° |
| C2D | C3D | CAD | HAD1 | 10.0° | 0.4° |
| C4D | ND | C1D | C2D | 1.0° | 0.3° |
| C4D | ND | C1D | HND | 180.0° | 179.7° |
| C4D | ND | C1D | CHC | 116.6° | 119.4° |
| C4D | ND | C1D | H1D1 | 118.0° | 119.0° |
| CMD | C2D | C1D | ND | 178.8° | 180.0° |
| CMD | C2D | C1D | CHC | 61.3° | 60.8° |
| CMD | C2D | C1D | H1D1 | 60.9° | 60.8° |
| C2D | CMD | HMD2 | HMD1 | 120.0° | 120.0° |
| C2D | CMD | HMD2 | HMD3 | 120.0° | 119.9° |
| C2D | CMD | HMD1 | HMD3 | 120.0° | 120.0° |
| C2D | C1D | ND | CHC | 117.6° | 119.2° |
| C2D | C1D | ND | H1D1 | 117.0° | 119.3° |
| C2D | C1D | CHC | H1D1 | 121.9° | 121.7° |
| C2D | C1D | CHC | C4C | 179.9° | 176.9° |
| C2D | C1D | CHC | HHC2 | 60.0° | 63.0° |
| C2D | C1D | CHC | HHC1 | 59.7° | 56.9° |
| C2D | C1D | ND | HND | 179.0° | 180.0° |
| C1D | C2D | CMD | HMD2 | 1.3° | 89.9° |
| C1D | C2D | CMD | HMD1 | 121.2° | 150.1° |
| C1D | C2D | CMD | HMD3 | 118.8° | 30.0° |
| CMC | C3C | C4C | CHC | 0.8° | 0.4° |
| CMC | C3C | C4C | C2C | 179.1° | 179.6° |
| CMC | C3C | C4C | NC | 178.6° | 180.0° |
| CMC | C3C | C2C | CAC | 0.1° | 0.1° |
| CMC | C3C | C2C | C1C | 178.6° | 179.8° |
| C3C | CMC | HMC1 | HMC3 | 120.0° | 119.9° |
| C3C | CMC | HMC1 | HMC2 | 120.0° | 120.0° |
| C3C | CMC | HMC3 | HMC2 | 120.0° | 120.0° |
| ND | C1D | CHC | H1D1 | 125.7° | 121.6° |
| ND | C1D | CHC | C4C | 67.5° | 66.4° |
| ND | C1D | CHC | HHC2 | 172.4° | 53.6° |
| ND | C1D | CHC | HHC1 | 52.7° | 173.5° |
| C1D | CHC | C4C | HHC2 | 120.1° | 120.0° |
| C1D | CHC | C4C | HHC1 | 120.1° | 120.0° |
| C1D | CHC | C4C | C3C | 100.0° | 85.0° |
| C1D | CHC | C4C | NC | 80.6° | 95.5° |
| C1D | CHC | HHC2 | HHC1 | 119.6° | 119.9° |
| CHC | C1D | ND | HND | 63.4° | 60.8° |
| CHC | C4C | C3C | NC | 179.4° | 179.6° |
| CHC | C4C | C3C | C2C | 179.9° | 180.0° |
| CHC | C4C | NC | C1C | 179.7° | 180.0° |
| C4C | CHC | HHC2 | HHC1 | 119.6° | 120.0° |
| CHC | C4C | NC | H4 | 0.2° | 0.3° |
| C4C | CHC | C1D | H1D1 | 58.2° | 55.2° |
| C4C | C3C | C2C | CAC | 178.9° | 179.7° |
| C4C | C3C | C2C | C1C | 0.4° | 0.2° |
| C3C | C4C | NC | C1C | 0.3° | 0.4° |
| C3C | C4C | CHC | HHC2 | 139.8° | 155.0° |
| C3C | C4C | CHC | HHC1 | 20.1° | 35.0° |
| C3C | C4C | NC | H4 | 179.7° | 179.9° |
| C4C | C3C | CMC | HMC1 | 90.5° | 90.0° |
| C4C | C3C | CMC | HMC3 | 149.5° | 150.1° |
| C4C | C3C | CMC | HMC2 | 29.5° | 30.0° |
| C2C | C3C | C4C | NC | 0.4° | 0.4° |
| C3C | C2C | CAC | C1C | 178.3° | 180.0° |
| C3C | C2C | CAC | CBC | 79.6° | 90.0° |
| C3C | C2C | C1C | NC | 0.2° | 0.0° |
| C3C | C2C | C1C | CHB | 178.1° | 179.9° |
| C2C | C3C | CMC | HMC1 | 90.6° | 90.5° |
| C2C | C3C | CMC | HMC3 | 29.4° | 29.5° |
| C2C | C3C | CMC | HMC2 | 149.4° | 149.5° |
| C3C | C2C | CAC | HAC2 | 160.0° | 30.0° |
| C3C | C2C | CAC | HAC1 | 40.9° | 150.0° |
| C4C | NC | C1C | C2C | 0.0° | 0.3° |
| C4C | NC | C1C | H4 | 180.0° | 179.7° |
| C4C | NC | C1C | CHB | 177.7° | 179.8° |
| NC | C4C | CHC | HHC2 | 39.5° | 24.5° |
| NC | C4C | CHC | HHC1 | 159.2° | 144.5° |
| O2C | CGC | CBC | O1C | 178.0° | 179.9° |
| O2C | CGC | CBC | CAC | 76.9° | 0.0° |
| O2C | CGC | CBC | HBC2 | 163.4° | 120.0° |
| O2C | CGC | CBC | HBC1 | 42.8° | 119.9° |
| O2C | CGC | O1C | H5 | 0.0° | 0.1° |
| C2C | CAC | CBC | CGC | 170.1° | 180.0° |
| C2C | CAC | CBC | HAC2 | 120.4° | 120.0° |
| C2C | CAC | CBC | HAC1 | 120.4° | 120.0° |
| CAC | C2C | C1C | NC | 178.8° | 180.0° |
| CAC | C2C | C1C | CHB | 3.4° | 0.1° |
| C2C | CAC | HAC2 | HAC1 | 118.7° | 120.0° |
| C2C | CAC | CBC | HBC2 | 70.2° | 60.0° |
| C2C | CAC | CBC | HBC1 | 50.4° | 60.0° |
| C1C | C2C | CAC | CBC | 102.2° | 90.0° |
| C2C | C1C | NC | CHB | 177.8° | 179.9° |
| C2C | C1C | CHB | C4B | 172.4° | 84.9° |
| C2C | C1C | CHB | HHB1 | 50.0° | 35.0° |
| C2C | C1C | CHB | H2 | 65.2° | 155.0° |
| C2C | C1C | NC | H4 | 179.9° | 180.0° |
| C1C | C2C | CAC | HAC2 | 18.2° | 150.0° |
| C1C | C2C | CAC | HAC1 | 137.4° | 30.0° |
| CGC | CBC | CAC | HBC2 | 119.7° | 120.0° |
| CGC | CBC | CAC | HBC1 | 119.7° | 120.0° |
| CGC | CBC | CAC | HAC2 | 69.5° | 60.0° |
| CGC | CBC | CAC | HAC1 | 49.6° | 60.0° |
| CGC | CBC | HBC2 | HBC1 | 121.0° | 120.0° |
| CBC | CGC | O1C | H5 | 178.0° | 180.0° |
| O1C | CGC | CBC | CAC | 101.1° | 179.9° |
| O1C | CGC | CBC | HBC2 | 18.6° | 60.1° |
| O1C | CGC | CBC | HBC1 | 139.2° | 60.0° |
| CBC | CAC | HAC2 | HAC1 | 118.7° | 120.0° |
| CAC | CBC | HBC2 | HBC1 | 120.9° | 120.0° |
| NC | C1C | CHB | C4B | 10.2° | 94.9° |
| NC | C1C | CHB | HHB1 | 132.6° | 145.1° |
| NC | C1C | CHB | H2 | 112.2° | 25.1° |
| C1C | CHB | C4B | HHB1 | 122.4° | 120.0° |
| C1C | CHB | C4B | H2 | 122.4° | 120.0° |
| C1C | CHB | C4B | NB | 12.1° | 94.9° |
| C1C | CHB | C4B | C3B | 169.3° | 85.0° |
| C1C | CHB | HHB1 | H2 | 111.9° | 120.0° |
| CHB | C1C | NC | H4 | 2.3° | 0.1° |
| CHB | C4B | NB | C3B | 178.8° | 179.9° |
| CHB | C4B | NB | C1B | 179.9° | 180.0° |
| CHB | C4B | C3B | CAB | 3.0° | 0.1° |
| CHB | C4B | C3B | C2B | 179.2° | 180.0° |
| CHB | C4B | NB | HNB | 0.1° | 0.2° |
| C4B | CHB | HHB1 | H2 | 111.9° | 120.0° |
| C4B | NB | C1B | HNB | 180.0° | 179.9° |
| C4B | NB | C1B | CHA | 176.6° | 180.0° |
| C4B | NB | C1B | C2B | 0.2° | 0.1° |
| NB | C4B | C3B | CAB | 178.2° | 180.0° |
| NB | C4B | C3B | C2B | 1.9° | 0.1° |
| NB | C4B | CHB | HHB1 | 134.5° | 25.0° |
| NB | C4B | CHB | H2 | 110.3° | 145.1° |
| C1B | NB | C4B | C3B | 1.3° | 0.1° |
| NB | C1B | CHA | C2B | 175.8° | 180.0° |
| NB | C1B | CHA | C4A | 155.4° | 17.2° |
| NB | C1B | C2B | C3B | 1.1° | 0.0° |
| NB | C1B | C2B | CMB | 179.0° | 180.0° |
| NB | C1B | CHA | HHA1 | 24.6° | 162.8° |
| C4B | C3B | C2B | C1B | 1.9° | 0.1° |
| C4B | C3B | CAB | C2B | 175.5° | 179.9° |
| C4B | C3B | CAB | CBB | 116.8° | 90.1° |
| C4B | C3B | C2B | CMB | 178.2° | 180.0° |
| C3B | C4B | NB | HNB | 178.7° | 179.8° |
| C3B | C4B | CHB | HHB1 | 46.9° | 155.0° |
| C3B | C4B | CHB | H2 | 68.3° | 35.0° |
| C4B | C3B | CAB | HAB1 | 122.4° | 29.9° |
| C4B | C3B | CAB | HAB2 | 4.1° | 150.0° |
| CBA | CAA | C3A | HAA1 | 120.5° | 120.0° |
| CBA | CAA | C3A | H1 | 120.5° | 120.0° |
| CBA | CAA | C3A | C4A | 52.2° | 84.6° |
| CBA | CAA | C3A | C2A | 129.1° | 95.1° |
| CAA | CBA | HBA1 | HBA2 | 120.0° | 120.1° |
| CAA | CBA | HBA1 | HBA3 | 120.0° | 119.9° |
| CAA | CBA | HBA2 | HBA3 | 120.0° | 120.0° |
| CBA | CAA | HAA1 | H1 | 118.4° | 120.1° |
| O1B | CGB | CBB | CAB | 3.5° | 0.0° |
| O1B | CGB | CBB | O2B | 179.3° | 180.0° |
| O1B | CGB | CBB | HBB2 | 124.0° | 120.0° |
| O1B | CGB | CBB | HBB1 | 117.0° | 119.9° |
| O1B | CGB | O2B | H3 | 0.0° | 0.0° |
| C1B | CHA | C4A | HHA1 | 180.0° | 180.0° |
| CHA | C1B | C2B | C3B | 177.2° | 180.0° |
| CHA | C1B | C2B | CMB | 2.9° | 0.0° |
| C1B | CHA | C4A | C3A | 175.8° | 172.8° |
| C1B | CHA | C4A | NA | 6.6° | 7.7° |
| CHA | C1B | NB | HNB | 3.4° | 0.1° |
| C2B | C1B | CHA | C4A | 28.9° | 162.8° |
| C1B | C2B | C3B | CAB | 178.0° | 180.0° |
| C1B | C2B | C3B | CMB | 179.9° | 180.0° |
| C2B | C1B | CHA | HHA1 | 151.1° | 17.2° |
| C2B | C1B | NB | HNB | 179.8° | 179.8° |
| C1B | C2B | CMB | HMB1 | 90.0° | 90.0° |
| C1B | C2B | CMB | HMB2 | 150.0° | 150.0° |
| C1B | C2B | CMB | HMB3 | 30.0° | 29.9° |
| CHA | C4A | C3A | CAA | 0.8° | 0.3° |
| CHA | C4A | C3A | NA | 177.9° | 179.6° |
| CHA | C4A | C3A | C2A | 178.1° | 180.0° |
| CHA | C4A | NA | C1A | 178.1° | 180.0° |
| CHA | C4A | NA | HNA | 1.9° | 0.2° |
| C3B | CAB | CBB | HAB1 | 120.9° | 120.0° |
| C3B | CAB | CBB | HAB2 | 120.9° | 120.0° |
| CAB | C3B | C2B | CMB | 2.0° | 0.1° |
| C3B | CAB | CBB | CGB | 88.0° | 180.0° |
| C3B | CAB | HAB1 | HAB2 | 117.3° | 120.1° |
| C3B | CAB | CBB | HBB2 | 32.5° | 60.0° |
| C3B | CAB | CBB | HBB1 | 151.5° | 60.0° |
| C2B | C3B | CAB | CBB | 67.7° | 90.1° |
| C3B | C2B | CMB | HMB1 | 90.0° | 90.0° |
| C3B | C2B | CMB | HMB2 | 30.0° | 30.0° |
| C3B | C2B | CMB | HMB3 | 150.0° | 150.1° |
| C2B | C3B | CAB | HAB1 | 53.2° | 149.9° |
| C2B | C3B | CAB | HAB2 | 171.5° | 29.9° |
| CAA | C3A | C4A | C2A | 178.9° | 179.7° |
| CAA | C3A | C4A | NA | 178.7° | 179.8° |
| CAA | C3A | C2A | CMA | 0.2° | 0.0° |
| CAA | C3A | C2A | C1A | 178.8° | 180.0° |
| C3A | CAA | CBA | HBA1 | 180.0° | 60.0° |
| C3A | CAA | CBA | HBA2 | 60.0° | 60.0° |
| C3A | CAA | CBA | HBA3 | 60.0° | 180.0° |
| C3A | CAA | HAA1 | H1 | 118.4° | 119.9° |
| CAB | CBB | CGB | HBB2 | 120.5° | 120.0° |
| CAB | CBB | CGB | HBB1 | 120.5° | 119.9° |
| CAB | CBB | CGB | O2B | 177.3° | 180.0° |
| CBB | CAB | HAB1 | HAB2 | 117.3° | 119.9° |
| CAB | CBB | HBB2 | HBB1 | 118.5° | 120.0° |
| C2B | CMB | HMB1 | HMB2 | 120.0° | 120.0° |
| C2B | CMB | HMB1 | HMB3 | 120.0° | 120.0° |
| C2B | CMB | HMB2 | HMB3 | 120.0° | 120.1° |
| CGB | CBB | CAB | HAB1 | 151.1° | 59.9° |
| CGB | CBB | CAB | HAB2 | 32.9° | 60.0° |
| CGB | CBB | HBB2 | HBB1 | 118.4° | 120.0° |
| CBB | CGB | O2B | H3 | 179.3° | 180.0° |
| O2B | CGB | CBB | HBB2 | 56.7° | 60.0° |
| O2B | CGB | CBB | HBB1 | 62.2° | 60.1° |
| C3A | C4A | NA | C1A | 0.1° | 0.4° |
| C4A | C3A | C2A | CMA | 179.2° | 179.8° |
| C4A | C3A | C2A | C1A | 0.1° | 0.3° |
| C3A | C4A | NA | HNA | 179.8° | 179.7° |
| C3A | C4A | CHA | HHA1 | 4.2° | 7.2° |
| C4A | C3A | CAA | HAA1 | 68.3° | 35.4° |
| C4A | C3A | CAA | H1 | 172.7° | 155.4° |
| NA | C4A | C3A | C2A | 0.2° | 0.4° |
| C4A | NA | C1A | HNA | 180.0° | 179.9° |
| C4A | NA | C1A | C2A | 0.0° | 0.2° |
| C4A | NA | C1A | OA | 179.9° | 179.7° |
| NA | C4A | CHA | HHA1 | 173.4° | 172.2° |
| C3A | C2A | C1A | NA | 0.1° | 0.0° |
| C3A | C2A | CMA | C1A | 178.9° | 179.9° |
| C3A | C2A | C1A | OA | 179.8° | 180.0° |
| C3A | C2A | CMA | HMA2 | 180.0° | 180.0° |
| C3A | C2A | CMA | HMA1 | 60.0° | 60.0° |
| C3A | C2A | CMA | HMA3 | 60.0° | 60.0° |
| C2A | C3A | CAA | HAA1 | 110.4° | 144.9° |
| C2A | C3A | CAA | H1 | 8.6° | 25.0° |
| NA | C1A | C2A | CMA | 179.1° | 180.0° |
| NA | C1A | C2A | OA | 179.9° | 179.9° |
| CMA | C2A | C1A | OA | 0.8° | 0.1° |
| C2A | CMA | HMA2 | HMA1 | 120.0° | 119.9° |
| C2A | CMA | HMA2 | HMA3 | 120.0° | 120.0° |
| C2A | CMA | HMA1 | HMA3 | 120.0° | 120.0° |
| C2A | C1A | NA | HNA | 179.9° | 179.9° |
| C1A | C2A | CMA | HMA2 | 1.1° | 0.1° |
| C1A | C2A | CMA | HMA1 | 118.9° | 120.0° |
| C1A | C2A | CMA | HMA3 | 121.1° | 119.9° |
| OA | C1A | NA | HNA | 0.0° | 0.2° |
| HMA2 | CMA | HMA1 | HMA3 | 120.0° | 120.0° |
| HBA1 | CBA | HBA2 | HBA3 | 120.0° | 120.0° |
| HBA1 | CBA | CAA | HAA1 | 59.5° | 180.0° |
| HBA1 | CBA | CAA | H1 | 59.5° | 59.9° |
| HBA2 | CBA | CAA | HAA1 | 60.5° | 60.0° |
| HBA2 | CBA | CAA | H1 | 179.5° | 179.9° |
| HBA3 | CBA | CAA | HAA1 | 179.5° | 60.1° |
| HBA3 | CBA | CAA | H1 | 60.5° | 60.0° |
| HMB1 | CMB | HMB2 | HMB3 | 120.0° | 120.0° |
| HAB1 | CAB | CBB | HBB2 | 88.3° | 180.0° |
| HAB1 | CAB | CBB | HBB1 | 30.7° | 60.0° |
| HAB2 | CAB | CBB | HBB2 | 153.4° | 60.1° |
| HAB2 | CAB | CBB | HBB1 | 87.6° | 179.9° |
| HHC2 | CHC | C1D | H1D1 | 61.9° | 175.2° |
| HHC1 | CHC | C1D | H1D1 | 178.4° | 64.9° |
| HMC1 | CMC | HMC3 | HMC2 | 120.0° | 120.1° |
| HAC2 | CAC | CBC | HBC2 | 50.2° | 180.0° |
| HAC2 | CAC | CBC | HBC1 | 170.8° | 60.0° |
| HAC1 | CAC | CBC | HBC2 | 169.3° | 60.0° |
| HAC1 | CAC | CBC | HBC1 | 70.1° | 180.0° |
| HND | ND | C1D | H1D1 | 62.0° | 60.7° |
| HMD2 | CMD | HMD1 | HMD3 | 120.0° | 120.0° |
| HAD1 | CAD | CBD | HBD2 | 0.0° | 180.0° |
| HAD1 | CAD | CBD | HBD1 | 180.0° | 0.2° |
