HAS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| FE | NA | sing | 2.05Å | 1.97Å | |
| FE | NB | sing | 2.06Å | 1.97Å | |
| FE | NC | sing | 2.05Å | 1.96Å | |
| FE | ND | sing | 2.05Å | 1.96Å | |
| CHA | C1A | doub | 1.39Å | 1.37Å | |
| CHA | C4D | sing | 1.39Å | 1.37Å | |
| CHA | HHA | sing | 0.95Å | 1.08Å | |
| CHB | C1D | doub | 1.40Å | 1.38Å | |
| CHB | C1B | sing | 1.39Å | 1.37Å | |
| CHB | HHB | sing | 0.94Å | 1.08Å | |
| CHC | C4B | doub | 1.39Å | 1.38Å | |
| CHC | C1C | sing | 1.39Å | 1.38Å | |
| CHC | HHC | sing | 0.94Å | 1.08Å | |
| CHD | C4C | sing | 1.40Å | 1.38Å | |
| CHD | C4A | doub | 1.39Å | 1.38Å | |
| CHD | HHD | sing | 0.94Å | 1.08Å | |
| NA | C1A | sing | 1.36Å | 1.38Å | |
| NA | C4A | sing | 1.37Å | 1.38Å | |
| C1A | C2A | sing | 1.38Å | 1.44Å | |
| C2A | C3A | doub | 1.36Å | 1.35Å | |
| C2A | CAA | sing | 1.51Å | 1.52Å | |
| C3A | C4A | sing | 1.38Å | 1.45Å | |
| C3A | CMA | sing | 1.51Å | 1.52Å | |
| CMA | HMA1 | sing | 0.97Å | 1.10Å | |
| CMA | HMA2 | sing | 0.97Å | 1.10Å | |
| CMA | HMA3 | sing | 0.97Å | 1.10Å | |
| OMD | CMD | doub | 1.21Å | 1.21Å | |
| CAA | CBA | sing | 1.53Å | 1.53Å | |
| CAA | HAA1 | sing | 0.98Å | 1.10Å | |
| CAA | HAA2 | sing | 0.98Å | 1.10Å | |
| CBA | CGA | sing | 1.53Å | 1.52Å | |
| CBA | HBA1 | sing | 0.98Å | 1.10Å | |
| CBA | HBA2 | sing | 0.99Å | 1.10Å | |
| CGA | O1A | doub | 1.25Å | 1.24Å | |
| CGA | O2A | sing | 1.25Å | 1.25Å | |
| O2A | H2A | sing | 1.26Å | 0.95Å | |
| NB | C1B | doub | 1.37Å | 1.38Å | |
| NB | C4B | sing | 1.37Å | 1.38Å | |
| C1B | C2B | sing | 1.38Å | 1.45Å | |
| C2B | C3B | doub | 1.37Å | 1.34Å | |
| C2B | CMB | sing | 1.51Å | 1.52Å | |
| C3B | C4B | sing | 1.40Å | 1.46Å | |
| C3B | C11 | sing | 1.52Å | 1.52Å | |
| CMB | HMB1 | sing | 0.97Å | 1.10Å | |
| CMB | HMB2 | sing | 0.97Å | 1.10Å | |
| CMB | HMB3 | sing | 0.97Å | 1.10Å | |
| NC | C1C | sing | 1.36Å | 1.38Å | Aromatic |
| NC | C4C | sing | 1.39Å | 1.38Å | Aromatic |
| C1C | C2C | doub | 1.40Å | 1.44Å | Aromatic |
| C2C | C3C | sing | 1.41Å | 1.35Å | Aromatic |
| C2C | CMC | sing | 1.51Å | 1.52Å | |
| C3C | C4C | doub | 1.39Å | 1.45Å | Aromatic |
| C3C | CAC | sing | 1.50Å | 1.39Å | |
| CMC | HMC1 | sing | 0.97Å | 1.10Å | |
| CMC | HMC2 | sing | 0.97Å | 1.10Å | |
| CMC | HMC3 | sing | 0.97Å | 1.10Å | |
| CAC | CBC | doub | 1.32Å | 1.40Å | |
| CAC | HAC | sing | 0.94Å | 1.08Å | |
| CBC | HBC1 | sing | 0.94Å | 1.08Å | |
| CBC | HBC2 | sing | 0.94Å | 1.08Å | |
| ND | C1D | sing | 1.39Å | 1.38Å | |
| ND | C4D | doub | 1.36Å | 1.37Å | |
| C1D | C2D | sing | 1.39Å | 1.45Å | |
| C2D | C3D | doub | 1.41Å | 1.35Å | |
| C2D | CMD | sing | 1.46Å | 1.46Å | |
| C3D | C4D | sing | 1.39Å | 1.44Å | |
| C3D | CAD | sing | 1.51Å | 1.52Å | |
| CMD | HMD | sing | 0.94Å | 1.08Å | |
| CAD | CBD | sing | 1.53Å | 1.52Å | |
| CAD | HAD1 | sing | 0.98Å | 1.10Å | |
| CAD | HAD2 | sing | 0.98Å | 1.10Å | |
| CBD | CGD | sing | 1.52Å | 1.51Å | |
| CBD | HBD1 | sing | 0.99Å | 1.10Å | |
| CBD | HBD2 | sing | 0.98Å | 1.10Å | |
| CGD | O1D | doub | 1.25Å | 1.24Å | |
| CGD | O2D | sing | 1.25Å | 1.24Å | |
| O2D | H2D | sing | 0.79Å | 0.95Å | |
| C11 | O11 | sing | 1.44Å | 1.43Å | |
| C11 | C12 | sing | 1.54Å | 1.54Å | |
| C11 | H11 | sing | 0.99Å | 1.10Å | |
| O11 | HO1 | sing | 0.85Å | 0.95Å | |
| C12 | C13 | sing | 1.54Å | 1.53Å | |
| C12 | H121 | sing | 0.98Å | 1.10Å | |
| C12 | H122 | sing | 0.98Å | 1.10Å | |
| C13 | C14 | sing | 1.51Å | 1.54Å | |
| C13 | H131 | sing | 0.98Å | 1.10Å | |
| C13 | H132 | sing | 0.98Å | 1.10Å | |
| C14 | C15 | doub | 1.35Å | 1.40Å | |
| C14 | H14 | sing | 0.95Å | 1.08Å | |
| C15 | C16 | sing | 1.52Å | 1.52Å | |
| C15 | C26 | sing | 1.52Å | 1.52Å | |
| C16 | C17 | sing | 1.54Å | 1.52Å | |
| C16 | H161 | sing | 0.98Å | 1.10Å | |
| C16 | H162 | sing | 0.98Å | 1.10Å | |
| C17 | C18 | sing | 1.51Å | 1.53Å | |
| C17 | H171 | sing | 0.98Å | 1.10Å | |
| C17 | H172 | sing | 0.98Å | 1.10Å | |
| C18 | C19 | doub | 1.35Å | 1.40Å | |
| C18 | H18 | sing | 0.95Å | 1.08Å | |
| C19 | C20 | sing | 1.52Å | 1.52Å | |
| C19 | C27 | sing | 1.52Å | 1.52Å | |
| C20 | C21 | sing | 1.54Å | 1.53Å | |
| C20 | H201 | sing | 0.98Å | 1.10Å | |
| C20 | H202 | sing | 0.98Å | 1.10Å | |
| C21 | C22 | sing | 1.51Å | 1.53Å | |
| C21 | H211 | sing | 0.98Å | 1.10Å | |
| C21 | H212 | sing | 0.98Å | 1.10Å | |
| C22 | C23 | doub | 1.35Å | 1.40Å | |
| C22 | H22 | sing | 0.95Å | 1.08Å | |
| C23 | C24 | sing | 1.52Å | 1.52Å | |
| C23 | C25 | sing | 1.52Å | 1.52Å | |
| C24 | C28 | sing | 1.54Å | 1.51Å | |
| C24 | H241 | sing | 0.98Å | 1.10Å | |
| C24 | H242 | sing | 0.98Å | 1.10Å | |
| C25 | H251 | sing | 0.97Å | 1.10Å | |
| C25 | H252 | sing | 0.97Å | 1.10Å | |
| C25 | H253 | sing | 0.97Å | 1.10Å | |
| C26 | H261 | sing | 0.97Å | 1.10Å | |
| C26 | H262 | sing | 0.97Å | 1.10Å | |
| C26 | H263 | sing | 0.97Å | 1.10Å | |
| C27 | H271 | sing | 0.97Å | 1.10Å | |
| C27 | H272 | sing | 0.97Å | 1.10Å | |
| C27 | H273 | sing | 0.97Å | 1.10Å | |
| C28 | C29 | sing | 1.51Å | 1.53Å | |
| C28 | H281 | sing | 0.98Å | 1.10Å | |
| C28 | H282 | sing | 0.98Å | 1.10Å | |
| C29 | C30 | doub | 1.34Å | 1.40Å | |
| C29 | H29 | sing | 0.95Å | 1.08Å | |
| C30 | C31 | sing | 1.52Å | 1.52Å | |
| C30 | C32 | sing | 1.52Å | 1.52Å | |
| C31 | H311 | sing | 0.97Å | 1.10Å | |
| C31 | H312 | sing | 0.97Å | 1.10Å | |
| C31 | H313 | sing | 0.97Å | 1.10Å | |
| C32 | H321 | sing | 0.97Å | 1.10Å | |
| C32 | H322 | sing | 0.97Å | 1.10Å | |
| C32 | H323 | sing | 0.97Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NA | FE | NB | 176.9° | 169.7° |
| NA | FE | NC | 90.1° | 89.2° |
| NA | FE | ND | 89.9° | 89.5° |
| FE | NA | C1A | 127.9° | 126.6° |
| FE | NA | C4A | 128.1° | 127.7° |
| NB | FE | NC | 89.8° | 89.9° |
| NB | FE | ND | 89.8° | 89.5° |
| FE | NB | C1B | 128.0° | 127.5° |
| FE | NB | C4B | 128.1° | 126.6° |
| NC | FE | ND | 172.8° | 169.5° |
| FE | NC | C1C | 127.9° | 127.0° |
| FE | NC | C4C | 128.0° | 128.0° |
| FE | ND | C1D | 128.2° | 127.4° |
| FE | ND | C4D | 127.8° | 127.3° |
| C1A | CHA | C4D | 125.2° | 129.5° |
| C1A | CHA | HHA | 117.4° | 115.2° |
| CHA | C1A | NA | 124.4° | 123.5° |
| CHA | C1A | C2A | 123.5° | 126.4° |
| C4D | CHA | HHA | 117.4° | 115.3° |
| CHA | C4D | ND | 124.6° | 122.8° |
| CHA | C4D | C3D | 123.7° | 126.3° |
| C1D | CHB | C1B | 125.3° | 130.2° |
| C1D | CHB | HHB | 117.3° | 114.1° |
| CHB | C1D | ND | 124.2° | 121.8° |
| CHB | C1D | C2D | 124.5° | 126.5° |
| C1B | CHB | HHB | 117.4° | 115.6° |
| CHB | C1B | NB | 124.4° | 122.9° |
| CHB | C1B | C2B | 124.1° | 126.9° |
| C4B | CHC | C1C | 125.3° | 130.2° |
| C4B | CHC | HHC | 117.3° | 114.5° |
| CHC | C4B | NB | 123.9° | 122.9° |
| CHC | C4B | C3B | 124.6° | 127.0° |
| C1C | CHC | HHC | 117.4° | 115.3° |
| CHC | C1C | NC | 124.6° | 122.8° |
| CHC | C1C | C2C | 123.9° | 126.3° |
| C4C | CHD | C4A | 125.2° | 130.2° |
| C4C | CHD | HHD | 117.4° | 114.6° |
| CHD | C4C | NC | 124.3° | 121.3° |
| CHD | C4C | C3C | 124.3° | 126.5° |
| C4A | CHD | HHD | 117.4° | 115.2° |
| CHD | C4A | NA | 124.2° | 122.9° |
| CHD | C4A | C3A | 124.6° | 126.9° |
| C1A | NA | C4A | 103.9° | 105.4° |
| NA | C1A | C2A | 111.9° | 110.1° |
| NA | C4A | C3A | 111.2° | 110.2° |
| C1A | C2A | C3A | 106.4° | 107.0° |
| C1A | C2A | CAA | 126.4° | 126.5° |
| C3A | C2A | CAA | 127.2° | 126.5° |
| C2A | C3A | C4A | 106.6° | 107.3° |
| C2A | C3A | CMA | 126.3° | 125.4° |
| C2A | CAA | CBA | 113.7° | 114.0° |
| C2A | CAA | HAA1 | 108.4° | 110.1° |
| C2A | CAA | HAA2 | 108.4° | 109.5° |
| C4A | C3A | CMA | 127.0° | 127.3° |
| C3A | CMA | HMA1 | 109.5° | 110.4° |
| C3A | CMA | HMA2 | 109.5° | 110.1° |
| C3A | CMA | HMA3 | 109.5° | 109.5° |
| HMA1 | CMA | HMA2 | 109.5° | 108.2° |
| HMA1 | CMA | HMA3 | 109.5° | 109.3° |
| HMA2 | CMA | HMA3 | 109.4° | 109.3° |
| OMD | CMD | C2D | 125.3° | 126.5° |
| OMD | CMD | HMD | 117.3° | 116.2° |
| CBA | CAA | HAA1 | 108.4° | 108.7° |
| CBA | CAA | HAA2 | 108.4° | 108.5° |
| CAA | CBA | CGA | 112.1° | 114.6° |
| CAA | CBA | HBA1 | 108.8° | 108.8° |
| CAA | CBA | HBA2 | 108.8° | 108.7° |
| HAA1 | CAA | HAA2 | 109.5° | 105.8° |
| CGA | CBA | HBA1 | 108.8° | 108.6° |
| CGA | CBA | HBA2 | 108.8° | 108.6° |
| CBA | CGA | O1A | 118.4° | 118.0° |
| CBA | CGA | O2A | 119.3° | 118.0° |
| HBA1 | CBA | HBA2 | 109.5° | 107.4° |
| O1A | CGA | O2A | 122.3° | 124.0° |
| CGA | O2A | H2A | 109.5° | 111.2° |
| C1B | NB | C4B | 103.9° | 105.9° |
| NB | C1B | C2B | 111.5° | 110.2° |
| NB | C4B | C3B | 111.3° | 110.1° |
| C1B | C2B | C3B | 106.9° | 107.8° |
| C1B | C2B | CMB | 127.4° | 127.8° |
| C3B | C2B | CMB | 125.7° | 124.4° |
| C2B | C3B | C4B | 106.3° | 106.0° |
| C2B | C3B | C11 | 124.7° | 125.6° |
| C2B | CMB | HMB1 | 109.5° | 109.8° |
| C2B | CMB | HMB2 | 109.5° | 110.7° |
| C2B | CMB | HMB3 | 109.5° | 109.4° |
| C4B | C3B | C11 | 128.9° | 128.4° |
| C3B | C11 | O11 | 111.0° | 109.0° |
| C3B | C11 | C12 | 113.0° | 112.1° |
| C3B | C11 | H11 | 107.1° | 109.3° |
| HMB1 | CMB | HMB2 | 109.5° | 108.6° |
| HMB1 | CMB | HMB3 | 109.4° | 109.2° |
| HMB2 | CMB | HMB3 | 109.5° | 109.1° |
| C1C | NC | C4C | 104.1° | 104.9° |
| NC | C1C | C2C | 111.5° | 110.9° |
| NC | C4C | C3C | 111.4° | 112.2° |
| C1C | C2C | C3C | 106.8° | 107.8° |
| C1C | C2C | CMC | 126.0° | 126.5° |
| C3C | C2C | CMC | 127.1° | 125.7° |
| C2C | C3C | C4C | 106.3° | 104.2° |
| C2C | C3C | CAC | 127.5° | 130.7° |
| C2C | CMC | HMC1 | 109.5° | 109.7° |
| C2C | CMC | HMC2 | 109.5° | 110.3° |
| C2C | CMC | HMC3 | 109.5° | 109.6° |
| C4C | C3C | CAC | 126.2° | 125.0° |
| C3C | CAC | CBC | 123.5° | 135.3° |
| C3C | CAC | HAC | 118.3° | 114.9° |
| HMC1 | CMC | HMC2 | 109.5° | 108.4° |
| HMC1 | CMC | HMC3 | 109.5° | 109.4° |
| HMC2 | CMC | HMC3 | 109.5° | 109.4° |
| CBC | CAC | HAC | 118.2° | 109.7° |
| CAC | CBC | HBC1 | 120.0° | 119.7° |
| CAC | CBC | HBC2 | 120.0° | 120.6° |
| HBC1 | CBC | HBC2 | 120.0° | 119.7° |
| C1D | ND | C4D | 104.0° | 105.0° |
| ND | C1D | C2D | 111.3° | 111.7° |
| ND | C4D | C3D | 111.6° | 110.9° |
| C1D | C2D | C3D | 106.5° | 104.7° |
| C1D | C2D | CMD | 127.6° | 130.7° |
| C3D | C2D | CMD | 126.0° | 124.6° |
| C2D | C3D | C4D | 106.7° | 107.7° |
| C2D | C3D | CAD | 126.8° | 125.8° |
| C2D | CMD | HMD | 117.3° | 117.3° |
| C4D | C3D | CAD | 126.5° | 126.5° |
| C3D | CAD | CBD | 112.5° | 113.6° |
| C3D | CAD | HAD1 | 108.7° | 109.7° |
| C3D | CAD | HAD2 | 108.7° | 109.7° |
| CBD | CAD | HAD1 | 108.7° | 108.7° |
| CBD | CAD | HAD2 | 108.7° | 108.7° |
| CAD | CBD | CGD | 112.4° | 114.6° |
| CAD | CBD | HBD1 | 108.7° | 108.7° |
| CAD | CBD | HBD2 | 108.7° | 108.7° |
| HAD1 | CAD | HAD2 | 109.4° | 106.1° |
| CGD | CBD | HBD1 | 108.8° | 108.5° |
| CGD | CBD | HBD2 | 108.7° | 108.6° |
| CBD | CGD | O1D | 118.7° | 118.0° |
| CBD | CGD | O2D | 118.7° | 118.0° |
| HBD1 | CBD | HBD2 | 109.5° | 107.4° |
| O1D | CGD | O2D | 122.6° | 124.0° |
| CGD | O2D | H2D | 109.5° | 118.7° |
| O11 | C11 | C12 | 110.5° | 112.4° |
| O11 | C11 | H11 | 108.2° | 106.9° |
| C11 | O11 | HO1 | 109.5° | 110.7° |
| C12 | C11 | H11 | 106.9° | 107.0° |
| C11 | C12 | C13 | 114.6° | 115.6° |
| C11 | C12 | H121 | 108.2° | 108.7° |
| C11 | C12 | H122 | 108.2° | 108.5° |
| C13 | C12 | H121 | 108.2° | 108.3° |
| C13 | C12 | H122 | 108.2° | 108.5° |
| C12 | C13 | C14 | 113.8° | 115.1° |
| C12 | C13 | H131 | 108.4° | 108.3° |
| C12 | C13 | H132 | 108.3° | 108.6° |
| H121 | C12 | H122 | 109.4° | 106.9° |
| C14 | C13 | H131 | 108.4° | 109.1° |
| C14 | C13 | H132 | 108.4° | 108.8° |
| C13 | C14 | C15 | 123.6° | 130.8° |
| C13 | C14 | H14 | 118.2° | 113.4° |
| H131 | C13 | H132 | 109.5° | 106.6° |
| C15 | C14 | H14 | 118.2° | 115.8° |
| C14 | C15 | C16 | 120.2° | 120.0° |
| C14 | C15 | C26 | 122.4° | 125.8° |
| C16 | C15 | C26 | 117.3° | 114.2° |
| C15 | C16 | C17 | 112.2° | 114.8° |
| C15 | C16 | H161 | 108.8° | 109.3° |
| C15 | C16 | H162 | 108.8° | 108.7° |
| C15 | C26 | H261 | 109.5° | 110.7° |
| C15 | C26 | H262 | 109.5° | 109.7° |
| C15 | C26 | H263 | 109.5° | 109.6° |
| C17 | C16 | H161 | 108.8° | 108.4° |
| C17 | C16 | H162 | 108.8° | 108.4° |
| C16 | C17 | C18 | 112.1° | 114.1° |
| C16 | C17 | H171 | 108.8° | 108.7° |
| C16 | C17 | H172 | 108.8° | 108.9° |
| H161 | C16 | H162 | 109.5° | 106.9° |
| C18 | C17 | H171 | 108.8° | 109.1° |
| C18 | C17 | H172 | 108.8° | 108.9° |
| C17 | C18 | C19 | 123.5° | 130.5° |
| C17 | C18 | H18 | 118.3° | 113.9° |
| H171 | C17 | H172 | 109.4° | 106.9° |
| C19 | C18 | H18 | 118.2° | 115.6° |
| C18 | C19 | C20 | 120.2° | 120.0° |
| C18 | C19 | C27 | 121.9° | 125.5° |
| C20 | C19 | C27 | 117.9° | 114.4° |
| C19 | C20 | C21 | 112.1° | 114.6° |
| C19 | C20 | H201 | 108.8° | 108.7° |
| C19 | C20 | H202 | 108.8° | 109.3° |
| C19 | C27 | H271 | 109.5° | 110.8° |
| C19 | C27 | H272 | 109.4° | 109.7° |
| C19 | C27 | H273 | 109.5° | 109.6° |
| C21 | C20 | H201 | 108.8° | 108.4° |
| C21 | C20 | H202 | 108.8° | 108.5° |
| C20 | C21 | C22 | 112.3° | 114.3° |
| C20 | C21 | H211 | 108.8° | 108.9° |
| C20 | C21 | H212 | 108.8° | 108.5° |
| H201 | C20 | H202 | 109.5° | 107.1° |
| C22 | C21 | H211 | 108.7° | 108.9° |
| C22 | C21 | H212 | 108.8° | 109.2° |
| C21 | C22 | C23 | 122.1° | 130.7° |
| C21 | C22 | H22 | 118.9° | 113.6° |
| H211 | C21 | H212 | 109.5° | 106.7° |
| C23 | C22 | H22 | 119.0° | 115.7° |
| C22 | C23 | C24 | 120.2° | 120.1° |
| C22 | C23 | C25 | 121.9° | 125.6° |
| C24 | C23 | C25 | 117.8° | 114.3° |
| C23 | C24 | C28 | 113.5° | 114.9° |
| C23 | C24 | H241 | 108.5° | 108.7° |
| C23 | C24 | H242 | 108.5° | 109.2° |
| C23 | C25 | H251 | 109.5° | 110.7° |
| C23 | C25 | H252 | 109.5° | 109.7° |
| C23 | C25 | H253 | 109.5° | 109.6° |
| C28 | C24 | H241 | 108.5° | 108.4° |
| C28 | C24 | H242 | 108.4° | 108.4° |
| C24 | C28 | C29 | 112.2° | 114.6° |
| C24 | C28 | H281 | 108.8° | 108.8° |
| C24 | C28 | H282 | 108.8° | 108.6° |
| H241 | C24 | H242 | 109.5° | 107.0° |
| H251 | C25 | H252 | 109.5° | 108.8° |
| H251 | C25 | H253 | 109.5° | 108.8° |
| H252 | C25 | H253 | 109.4° | 109.1° |
| H261 | C26 | H262 | 109.4° | 108.7° |
| H261 | C26 | H263 | 109.5° | 109.0° |
| H262 | C26 | H263 | 109.5° | 109.1° |
| H271 | C27 | H272 | 109.5° | 108.8° |
| H271 | C27 | H273 | 109.4° | 108.8° |
| H272 | C27 | H273 | 109.5° | 109.1° |
| C29 | C28 | H281 | 108.8° | 108.9° |
| C29 | C28 | H282 | 108.8° | 109.0° |
| C28 | C29 | C30 | 123.9° | 130.7° |
| C28 | C29 | H29 | 118.1° | 113.4° |
| H281 | C28 | H282 | 109.5° | 106.6° |
| C30 | C29 | H29 | 118.1° | 115.8° |
| C29 | C30 | C31 | 121.2° | 120.9° |
| C29 | C30 | C32 | 121.8° | 126.1° |
| C31 | C30 | C32 | 117.0° | 113.1° |
| C30 | C31 | H311 | 109.5° | 110.4° |
| C30 | C31 | H312 | 109.5° | 109.8° |
| C30 | C31 | H313 | 109.5° | 109.8° |
| C30 | C32 | H321 | 109.5° | 110.6° |
| C30 | C32 | H322 | 109.5° | 109.8° |
| C30 | C32 | H323 | 109.5° | 109.7° |
| H311 | C31 | H312 | 109.4° | 108.8° |
| H311 | C31 | H313 | 109.4° | 108.8° |
| H312 | C31 | H313 | 109.5° | 109.2° |
| H321 | C32 | H322 | 109.5° | 108.8° |
| H321 | C32 | H323 | 109.4° | 108.7° |
| H322 | C32 | H323 | 109.5° | 109.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NA | FE | NB | NC | 88.1° | 85.3° |
| NA | FE | NB | ND | 84.7° | 84.2° |
| NA | FE | NC | ND | 90.2° | 82.9° |
| FE | NA | C1A | CHA | 2.5° | 5.9° |
| FE | NA | C4A | CHD | 0.3° | 6.1° |
| FE | NA | C1A | C4A | 177.6° | 174.2° |
| FE | NA | C1A | C2A | 177.9° | 174.1° |
| FE | NA | C4A | C3A | 177.3° | 174.1° |
| NA | FE | NB | C1B | 85.8° | 91.4° |
| NA | FE | NB | C4B | 95.0° | 92.5° |
| NA | FE | NC | C1C | 179.6° | 177.4° |
| NA | FE | NC | C4C | 1.6° | 7.5° |
| NA | FE | ND | C1D | 175.2° | 178.2° |
| NA | FE | ND | C4D | 2.9° | 8.9° |
| NB | FE | NC | ND | 86.7° | 86.8° |
| FE | NB | C1B | CHB | 3.0° | 3.0° |
| FE | NB | C4B | CHC | 7.0° | 3.0° |
| NB | FE | NA | C1A | 88.2° | 93.1° |
| NB | FE | NA | C4A | 88.8° | 94.0° |
| FE | NB | C1B | C4B | 179.3° | 176.8° |
| FE | NB | C1B | C2B | 178.2° | 178.1° |
| FE | NB | C4B | C3B | 177.5° | 178.1° |
| NB | FE | NC | C1C | 3.5° | 7.7° |
| NB | FE | NC | C4C | 178.5° | 177.2° |
| NB | FE | ND | C1D | 1.8° | 8.5° |
| NB | FE | ND | C4D | 179.9° | 178.6° |
| FE | NC | C1C | CHC | 0.1° | 4.0° |
| FE | NC | C4C | CHD | 1.6° | 3.8° |
| NC | FE | NA | C1A | 176.3° | 178.4° |
| NC | FE | NA | C4A | 0.7° | 8.6° |
| NC | FE | NB | C1B | 174.0° | 176.7° |
| NC | FE | NB | C4B | 6.9° | 7.2° |
| FE | NC | C1C | C4C | 178.4° | 176.0° |
| FE | NC | C1C | C2C | 179.1° | 176.6° |
| FE | NC | C4C | C3C | 178.6° | 177.1° |
| NC | FE | ND | C1D | 85.0° | 95.4° |
| NC | FE | ND | C4D | 93.2° | 91.7° |
| FE | ND | C4D | CHA | 1.2° | 5.9° |
| FE | ND | C1D | CHB | 3.2° | 5.7° |
| ND | FE | NA | C1A | 3.6° | 8.9° |
| ND | FE | NA | C4A | 173.5° | 178.2° |
| ND | FE | NB | C1B | 1.2° | 7.2° |
| ND | FE | NB | C4B | 179.6° | 176.7° |
| ND | FE | NC | C1C | 90.2° | 94.6° |
| ND | FE | NC | C4C | 91.8° | 90.3° |
| FE | ND | C1D | C4D | 178.5° | 174.2° |
| FE | ND | C1D | C2D | 177.7° | 173.8° |
| FE | ND | C4D | C3D | 177.9° | 174.3° |
| C1A | CHA | C4D | HHA | 180.0° | 179.4° |
| CHA | C1A | NA | C2A | 175.4° | 180.0° |
| CHA | C1A | NA | C4A | 175.1° | 179.8° |
| CHA | C1A | C2A | C3A | 174.6° | 179.8° |
| CHA | C1A | C2A | CAA | 6.0° | 0.5° |
| C1A | CHA | C4D | ND | 1.3° | 1.0° |
| C1A | CHA | C4D | C3D | 175.0° | 178.7° |
| C4D | CHA | C1A | NA | 0.7° | 1.0° |
| C4D | CHA | C1A | C2A | 174.2° | 179.0° |
| CHA | C4D | ND | C1D | 177.3° | 179.9° |
| CHA | C4D | ND | C3D | 176.7° | 179.8° |
| CHA | C4D | C3D | C2D | 176.9° | 179.7° |
| CHA | C4D | C3D | CAD | 2.4° | 0.6° |
| HHA | CHA | C1A | NA | 179.3° | 178.4° |
| HHA | CHA | C1A | C2A | 5.8° | 1.6° |
| HHA | CHA | C4D | ND | 178.7° | 178.3° |
| HHA | CHA | C4D | C3D | 5.0° | 1.9° |
| C1D | CHB | C1B | HHB | 180.0° | 177.8° |
| C1D | CHB | C1B | NB | 1.8° | 3.6° |
| C1D | CHB | C1B | C2B | 179.5° | 175.1° |
| CHB | C1D | ND | C2D | 179.0° | 179.6° |
| CHB | C1D | ND | C4D | 178.3° | 179.9° |
| CHB | C1D | C2D | C3D | 178.3° | 179.8° |
| CHB | C1D | C2D | CMD | 2.0° | 0.7° |
| CHB | C1B | NB | C2B | 178.8° | 178.9° |
| CHB | C1B | NB | C4B | 177.7° | 179.8° |
| CHB | C1B | C2B | C3B | 178.8° | 179.8° |
| CHB | C1B | C2B | CMB | 0.0° | 1.0° |
| C1B | CHB | C1D | ND | 1.4° | 2.1° |
| C1B | CHB | C1D | C2D | 179.7° | 178.4° |
| HHB | CHB | C1B | NB | 178.2° | 174.2° |
| HHB | CHB | C1B | C2B | 0.5° | 7.2° |
| HHB | CHB | C1D | ND | 178.6° | 175.7° |
| HHB | CHB | C1D | C2D | 0.3° | 3.8° |
| C4B | CHC | C1C | HHC | 180.0° | 176.7° |
| CHC | C4B | NB | C1B | 173.6° | 179.8° |
| CHC | C4B | NB | C3B | 175.5° | 179.0° |
| CHC | C4B | C3B | C2B | 173.6° | 179.6° |
| CHC | C4B | C3B | C11 | 9.8° | 0.7° |
| C4B | CHC | C1C | NC | 2.2° | 4.0° |
| C4B | CHC | C1C | C2C | 178.8° | 175.3° |
| C1C | CHC | C4B | NB | 1.4° | 4.6° |
| C1C | CHC | C4B | C3B | 176.3° | 174.2° |
| CHC | C1C | NC | C2C | 179.1° | 179.4° |
| CHC | C1C | NC | C4C | 178.3° | 179.9° |
| CHC | C1C | C2C | C3C | 178.1° | 179.1° |
| CHC | C1C | C2C | CMC | 4.5° | 0.2° |
| HHC | CHC | C4B | NB | 178.6° | 172.1° |
| HHC | CHC | C4B | C3B | 3.7° | 9.1° |
| HHC | CHC | C1C | NC | 177.8° | 172.7° |
| HHC | CHC | C1C | C2C | 1.2° | 8.0° |
| C4C | CHD | C4A | HHD | 180.0° | 179.1° |
| C4C | CHD | C4A | NA | 0.9° | 1.4° |
| C4C | CHD | C4A | C3A | 176.3° | 178.4° |
| CHD | C4C | NC | C1C | 179.9° | 179.7° |
| CHD | C4C | NC | C3C | 179.8° | 179.1° |
| CHD | C4C | C3C | C2C | 179.4° | 179.6° |
| CHD | C4C | C3C | CAC | 1.8° | 1.6° |
| CHD | C4A | NA | C1A | 177.9° | 179.8° |
| CHD | C4A | NA | C3A | 177.5° | 179.8° |
| CHD | C4A | C3A | C2A | 178.4° | 179.9° |
| CHD | C4A | C3A | CMA | 1.2° | 0.2° |
| C4A | CHD | C4C | NC | 0.1° | 2.6° |
| C4A | CHD | C4C | C3C | 179.9° | 176.4° |
| HHD | CHD | C4A | NA | 179.2° | 177.7° |
| HHD | CHD | C4A | C3A | 3.6° | 2.5° |
| HHD | CHD | C4C | NC | 179.9° | 176.5° |
| HHD | CHD | C4C | C3C | 0.1° | 4.6° |
| NA | C1A | C2A | C3A | 0.8° | 0.2° |
| NA | C1A | C2A | CAA | 178.6° | 179.5° |
| C1A | NA | C4A | C3A | 0.4° | 0.1° |
| C4A | NA | C1A | C2A | 0.3° | 0.2° |
| NA | C4A | C3A | C2A | 0.9° | 0.1° |
| NA | C4A | C3A | CMA | 176.3° | 179.6° |
| C1A | C2A | C3A | CAA | 179.4° | 179.3° |
| C1A | C2A | C3A | C4A | 1.0° | 0.2° |
| C1A | C2A | C3A | CMA | 176.2° | 179.6° |
| C1A | C2A | CAA | CBA | 99.8° | 86.6° |
| C1A | C2A | CAA | HAA1 | 20.8° | 151.0° |
| C1A | C2A | CAA | HAA2 | 139.5° | 35.2° |
| C2A | C3A | C4A | CMA | 177.2° | 179.7° |
| C2A | C3A | CMA | HMA1 | 180.0° | 158.9° |
| C2A | C3A | CMA | HMA2 | 60.0° | 39.5° |
| C2A | C3A | CMA | HMA3 | 60.0° | 80.7° |
| C3A | C2A | CAA | CBA | 80.9° | 92.6° |
| C3A | C2A | CAA | HAA1 | 158.5° | 29.8° |
| C3A | C2A | CAA | HAA2 | 39.7° | 145.7° |
| CAA | C2A | C3A | C4A | 178.4° | 179.4° |
| CAA | C2A | C3A | CMA | 4.4° | 0.3° |
| C2A | CAA | CBA | HAA1 | 120.6° | 123.2° |
| C2A | CAA | CBA | HAA2 | 120.6° | 122.3° |
| C2A | CAA | HAA1 | HAA2 | 118.1° | 118.2° |
| C2A | CAA | CBA | CGA | 179.5° | 176.3° |
| C2A | CAA | CBA | HBA1 | 59.1° | 54.6° |
| C2A | CAA | CBA | HBA2 | 60.0° | 62.1° |
| C4A | C3A | CMA | HMA1 | 3.4° | 21.5° |
| C4A | C3A | CMA | HMA2 | 116.6° | 140.9° |
| C4A | C3A | CMA | HMA3 | 123.4° | 98.9° |
| C3A | CMA | HMA1 | HMA2 | 120.0° | 120.6° |
| C3A | CMA | HMA1 | HMA3 | 120.0° | 120.6° |
| C3A | CMA | HMA2 | HMA3 | 120.0° | 120.4° |
| HMA1 | CMA | HMA2 | HMA3 | 120.0° | 118.9° |
| OMD | CMD | C2D | C1D | 28.7° | 3.7° |
| OMD | CMD | C2D | C3D | 150.9° | 175.2° |
| OMD | CMD | C2D | HMD | 180.0° | 178.7° |
| CBA | CAA | HAA1 | HAA2 | 118.1° | 116.4° |
| CAA | CBA | CGA | HBA1 | 120.4° | 121.8° |
| CAA | CBA | CGA | HBA2 | 120.4° | 121.7° |
| CAA | CBA | HBA1 | HBA2 | 118.7° | 117.5° |
| CAA | CBA | CGA | O1A | 86.3° | 98.1° |
| CAA | CBA | CGA | O2A | 92.0° | 81.9° |
| HAA1 | CAA | CBA | CGA | 59.8° | 60.6° |
| HAA1 | CAA | CBA | HBA1 | 179.8° | 177.8° |
| HAA1 | CAA | CBA | HBA2 | 60.6° | 61.1° |
| HAA2 | CAA | CBA | CGA | 58.9° | 54.0° |
| HAA2 | CAA | CBA | HBA1 | 61.5° | 67.6° |
| HAA2 | CAA | CBA | HBA2 | 179.3° | 175.7° |
| CGA | CBA | HBA1 | HBA2 | 118.8° | 117.2° |
| CBA | CGA | O1A | O2A | 178.2° | 180.0° |
| CBA | CGA | O2A | H2A | 178.2° | 129.1° |
| HBA1 | CBA | CGA | O1A | 34.1° | 140.1° |
| HBA1 | CBA | CGA | O2A | 147.6° | 39.9° |
| HBA2 | CBA | CGA | O1A | 153.3° | 23.6° |
| HBA2 | CBA | CGA | O2A | 28.4° | 156.4° |
| O1A | CGA | O2A | H2A | 0.0° | 50.9° |
| NB | C1B | C2B | C3B | 0.0° | 1.0° |
| NB | C1B | C2B | CMB | 178.9° | 179.8° |
| C1B | NB | C4B | C3B | 1.8° | 1.2° |
| C4B | NB | C1B | C2B | 1.2° | 1.3° |
| NB | C4B | C3B | C2B | 1.9° | 0.7° |
| NB | C4B | C3B | C11 | 174.8° | 179.6° |
| C1B | C2B | C3B | CMB | 178.9° | 179.2° |
| C1B | C2B | C3B | C4B | 1.0° | 0.2° |
| C1B | C2B | C3B | C11 | 175.8° | 179.6° |
| C1B | C2B | CMB | HMB1 | 180.0° | 127.2° |
| C1B | C2B | CMB | HMB2 | 60.0° | 7.2° |
| C1B | C2B | CMB | HMB3 | 60.0° | 113.1° |
| C2B | C3B | C4B | C11 | 176.7° | 179.7° |
| C3B | C2B | CMB | HMB1 | 1.4° | 53.8° |
| C3B | C2B | CMB | HMB2 | 121.4° | 173.8° |
| C3B | C2B | CMB | HMB3 | 118.6° | 66.0° |
| C2B | C3B | C11 | O11 | 121.6° | 130.2° |
| C2B | C3B | C11 | C12 | 113.7° | 104.7° |
| C2B | C3B | C11 | H11 | 3.8° | 13.6° |
| CMB | C2B | C3B | C4B | 177.8° | 179.4° |
| CMB | C2B | C3B | C11 | 5.4° | 0.3° |
| C2B | CMB | HMB1 | HMB2 | 120.0° | 121.2° |
| C2B | CMB | HMB1 | HMB3 | 120.0° | 119.9° |
| C2B | CMB | HMB2 | HMB3 | 120.0° | 120.4° |
| C4B | C3B | C11 | O11 | 62.3° | 50.2° |
| C4B | C3B | C11 | C12 | 62.4° | 74.9° |
| C4B | C3B | C11 | H11 | 179.9° | 166.7° |
| C3B | C11 | O11 | C12 | 126.1° | 124.9° |
| C3B | C11 | O11 | H11 | 117.2° | 118.0° |
| C3B | C11 | C12 | H11 | 117.5° | 119.7° |
| C3B | C11 | O11 | HO1 | 180.0° | 163.6° |
| C3B | C11 | C12 | C13 | 169.0° | 158.1° |
| C3B | C11 | C12 | H121 | 70.2° | 36.1° |
| C3B | C11 | C12 | H122 | 48.2° | 79.8° |
| HMB1 | CMB | HMB2 | HMB3 | 120.0° | 118.9° |
| NC | C1C | C2C | C3C | 1.0° | 0.3° |
| NC | C1C | C2C | CMC | 176.4° | 179.2° |
| C1C | NC | C4C | C3C | 0.3° | 1.2° |
| C4C | NC | C1C | C2C | 0.8° | 0.5° |
| NC | C4C | C3C | C2C | 0.4° | 1.3° |
| NC | C4C | C3C | CAC | 178.4° | 179.4° |
| C1C | C2C | C3C | CMC | 177.4° | 178.9° |
| C1C | C2C | C3C | C4C | 0.8° | 0.9° |
| C1C | C2C | C3C | CAC | 177.9° | 178.9° |
| C1C | C2C | CMC | HMC1 | 88.5° | 146.9° |
| C1C | C2C | CMC | HMC2 | 151.5° | 27.5° |
| C1C | C2C | CMC | HMC3 | 31.5° | 93.0° |
| C2C | C3C | C4C | CAC | 178.7° | 178.1° |
| C3C | C2C | CMC | HMC1 | 88.4° | 31.9° |
| C3C | C2C | CMC | HMC2 | 31.6° | 151.2° |
| C3C | C2C | CMC | HMC3 | 151.6° | 88.3° |
| C2C | C3C | CAC | CBC | 22.1° | 10.4° |
| C2C | C3C | CAC | HAC | 157.9° | 167.6° |
| CMC | C2C | C3C | C4C | 176.6° | 179.9° |
| CMC | C2C | C3C | CAC | 4.7° | 2.2° |
| C2C | CMC | HMC1 | HMC2 | 120.0° | 120.5° |
| C2C | CMC | HMC1 | HMC3 | 120.0° | 120.3° |
| C2C | CMC | HMC2 | HMC3 | 120.0° | 120.6° |
| C4C | C3C | CAC | CBC | 159.4° | 167.2° |
| C4C | C3C | CAC | HAC | 20.6° | 14.8° |
| C3C | CAC | CBC | HAC | 180.0° | 178.1° |
| C3C | CAC | CBC | HBC1 | 180.0° | 177.5° |
| C3C | CAC | CBC | HBC2 | 0.0° | 4.3° |
| HMC1 | CMC | HMC2 | HMC3 | 120.0° | 119.2° |
| CAC | CBC | HBC1 | HBC2 | 180.0° | 178.2° |
| HAC | CAC | CBC | HBC1 | 0.0° | 0.5° |
| HAC | CAC | CBC | HBC2 | 180.0° | 177.6° |
| ND | C1D | C2D | C3D | 0.7° | 0.7° |
| ND | C1D | C2D | CMD | 178.9° | 179.7° |
| C1D | ND | C4D | C3D | 0.5° | 0.1° |
| C4D | ND | C1D | C2D | 0.7° | 0.4° |
| ND | C4D | C3D | C2D | 0.1° | 0.6° |
| ND | C4D | C3D | CAD | 179.2° | 179.6° |
| C1D | C2D | C3D | CMD | 179.6° | 179.1° |
| C1D | C2D | C3D | C4D | 0.3° | 0.7° |
| C1D | C2D | C3D | CAD | 179.7° | 179.8° |
| C1D | C2D | CMD | HMD | 151.3° | 175.0° |
| C2D | C3D | C4D | CAD | 179.4° | 179.1° |
| C3D | C2D | CMD | HMD | 29.1° | 6.1° |
| C2D | C3D | CAD | CBD | 100.2° | 90.1° |
| C2D | C3D | CAD | HAD1 | 139.4° | 31.9° |
| C2D | C3D | CAD | HAD2 | 20.3° | 148.0° |
| CMD | C2D | C3D | C4D | 179.3° | 179.9° |
| CMD | C2D | C3D | CAD | 0.0° | 1.1° |
| C4D | C3D | CAD | CBD | 80.6° | 88.8° |
| C4D | C3D | CAD | HAD1 | 39.9° | 149.3° |
| C4D | C3D | CAD | HAD2 | 159.0° | 33.1° |
| C3D | CAD | CBD | HAD1 | 120.5° | 122.5° |
| C3D | CAD | CBD | HAD2 | 120.5° | 122.4° |
| C3D | CAD | HAD1 | HAD2 | 118.6° | 118.4° |
| C3D | CAD | CBD | CGD | 176.9° | 177.6° |
| C3D | CAD | CBD | HBD1 | 62.6° | 55.9° |
| C3D | CAD | CBD | HBD2 | 56.5° | 60.7° |
| CBD | CAD | HAD1 | HAD2 | 118.6° | 116.8° |
| CAD | CBD | CGD | HBD1 | 120.5° | 121.7° |
| CAD | CBD | CGD | HBD2 | 120.4° | 121.8° |
| CAD | CBD | HBD1 | HBD2 | 118.6° | 117.5° |
| CAD | CBD | CGD | O1D | 120.0° | 85.6° |
| CAD | CBD | CGD | O2D | 60.2° | 94.4° |
| HAD1 | CAD | CBD | CGD | 56.4° | 59.9° |
| HAD1 | CAD | CBD | HBD1 | 176.9° | 178.4° |
| HAD1 | CAD | CBD | HBD2 | 64.0° | 61.8° |
| HAD2 | CAD | CBD | CGD | 62.7° | 55.1° |
| HAD2 | CAD | CBD | HBD1 | 57.8° | 66.5° |
| HAD2 | CAD | CBD | HBD2 | 176.9° | 176.9° |
| CGD | CBD | HBD1 | HBD2 | 118.7° | 117.3° |
| CBD | CGD | O1D | O2D | 179.7° | 180.0° |
| CBD | CGD | O2D | H2D | 179.7° | 152.9° |
| HBD1 | CBD | CGD | O1D | 0.4° | 152.7° |
| HBD1 | CBD | CGD | O2D | 179.3° | 27.3° |
| HBD2 | CBD | CGD | O1D | 119.5° | 36.2° |
| HBD2 | CBD | CGD | O2D | 60.2° | 143.8° |
| O1D | CGD | O2D | H2D | 0.0° | 27.1° |
| O11 | C11 | C12 | H11 | 117.5° | 117.1° |
| O11 | C11 | C12 | C13 | 66.0° | 78.7° |
| O11 | C11 | C12 | H121 | 54.7° | 159.3° |
| O11 | C11 | C12 | H122 | 173.2° | 43.4° |
| C12 | C11 | O11 | HO1 | 53.9° | 71.5° |
| C11 | C12 | C13 | H121 | 120.8° | 122.2° |
| C11 | C12 | C13 | H122 | 120.8° | 122.1° |
| C11 | C12 | H121 | H122 | 117.7° | 116.9° |
| C11 | C12 | C13 | C14 | 173.5° | 173.0° |
| C11 | C12 | C13 | H131 | 65.9° | 50.7° |
| C11 | C12 | C13 | H132 | 52.8° | 64.8° |
| H11 | C11 | O11 | HO1 | 62.8° | 45.6° |
| H11 | C11 | C12 | C13 | 51.5° | 38.4° |
| H11 | C11 | C12 | H121 | 172.3° | 83.6° |
| H11 | C11 | C12 | H122 | 69.3° | 160.4° |
| C13 | C12 | H121 | H122 | 117.7° | 116.8° |
| C12 | C13 | C14 | H131 | 120.7° | 122.0° |
| C12 | C13 | C14 | H132 | 120.6° | 122.1° |
| C12 | C13 | H131 | H132 | 118.0° | 116.7° |
| C12 | C13 | C14 | C15 | 161.2° | 151.4° |
| C12 | C13 | C14 | H14 | 18.8° | 29.5° |
| H121 | C12 | C13 | C14 | 52.7° | 64.8° |
| H121 | C12 | C13 | H131 | 173.3° | 172.8° |
| H121 | C12 | C13 | H132 | 68.0° | 57.4° |
| H122 | C12 | C13 | C14 | 65.8° | 51.0° |
| H122 | C12 | C13 | H131 | 54.9° | 71.4° |
| H122 | C12 | C13 | H132 | 173.6° | 173.2° |
| C14 | C13 | H131 | H132 | 118.0° | 117.3° |
| C13 | C14 | C15 | H14 | 180.0° | 179.0° |
| C13 | C14 | C15 | C16 | 179.9° | 177.9° |
| C13 | C14 | C15 | C26 | 1.1° | 2.6° |
| H131 | C13 | C14 | C15 | 40.5° | 29.5° |
| H131 | C13 | C14 | H14 | 139.4° | 151.5° |
| H132 | C13 | C14 | C15 | 78.2° | 86.5° |
| H132 | C13 | C14 | H14 | 101.8° | 92.6° |
| C14 | C15 | C16 | C26 | 178.9° | 179.6° |
| C14 | C15 | C16 | C17 | 112.3° | 84.4° |
| C14 | C15 | C16 | H161 | 8.1° | 153.5° |
| C14 | C15 | C16 | H162 | 127.3° | 37.1° |
| C14 | C15 | C26 | H261 | 180.0° | 5.3° |
| C14 | C15 | C26 | H262 | 60.0° | 125.3° |
| C14 | C15 | C26 | H263 | 60.0° | 114.9° |
| H14 | C14 | C15 | C16 | 0.1° | 3.1° |
| H14 | C14 | C15 | C26 | 178.9° | 176.4° |
| C15 | C16 | C17 | H161 | 120.4° | 122.6° |
| C15 | C16 | C17 | H162 | 120.4° | 121.7° |
| C15 | C16 | H161 | H162 | 118.8° | 117.5° |
| C15 | C16 | C17 | C18 | 167.9° | 178.1° |
| C15 | C16 | C17 | H171 | 71.6° | 56.1° |
| C15 | C16 | C17 | H172 | 47.5° | 60.0° |
| C16 | C15 | C26 | H261 | 1.1° | 174.2° |
| C16 | C15 | C26 | H262 | 118.9° | 54.2° |
| C16 | C15 | C26 | H263 | 121.1° | 65.6° |
| C26 | C15 | C16 | C17 | 68.8° | 96.0° |
| C26 | C15 | C16 | H161 | 170.8° | 26.1° |
| C26 | C15 | C16 | H162 | 51.6° | 142.5° |
| C15 | C26 | H261 | H262 | 120.0° | 120.6° |
| C15 | C26 | H261 | H263 | 120.0° | 120.6° |
| C15 | C26 | H262 | H263 | 120.0° | 120.1° |
| C17 | C16 | H161 | H162 | 118.8° | 116.7° |
| C16 | C17 | C18 | H171 | 120.4° | 121.8° |
| C16 | C17 | C18 | H172 | 120.4° | 121.9° |
| C16 | C17 | H171 | H172 | 118.8° | 117.4° |
| C16 | C17 | C18 | C19 | 157.1° | 167.4° |
| C16 | C17 | C18 | H18 | 22.9° | 13.4° |
| H161 | C16 | C17 | C18 | 47.6° | 59.4° |
| H161 | C16 | C17 | H171 | 168.0° | 178.6° |
| H161 | C16 | C17 | H172 | 72.9° | 62.5° |
| H162 | C16 | C17 | C18 | 71.7° | 56.4° |
| H162 | C16 | C17 | H171 | 48.8° | 65.6° |
| H162 | C16 | C17 | H172 | 167.9° | 178.3° |
| C18 | C17 | H171 | H172 | 118.8° | 117.6° |
| C17 | C18 | C19 | H18 | 180.0° | 179.2° |
| C17 | C18 | C19 | C20 | 179.7° | 178.7° |
| C17 | C18 | C19 | C27 | 2.1° | 1.6° |
| H171 | C17 | C18 | C19 | 82.4° | 45.6° |
| H171 | C17 | C18 | H18 | 97.5° | 135.2° |
| H172 | C17 | C18 | C19 | 36.7° | 70.7° |
| H172 | C17 | C18 | H18 | 143.3° | 108.6° |
| C18 | C19 | C20 | C27 | 177.7° | 179.8° |
| C18 | C19 | C20 | C21 | 115.6° | 83.9° |
| C18 | C19 | C20 | H201 | 124.1° | 37.5° |
| C18 | C19 | C20 | H202 | 4.8° | 154.1° |
| C18 | C19 | C27 | H271 | 180.0° | 1.3° |
| C18 | C19 | C27 | H272 | 60.0° | 121.5° |
| C18 | C19 | C27 | H273 | 60.0° | 118.7° |
| H18 | C18 | C19 | C20 | 0.3° | 2.1° |
| H18 | C18 | C19 | C27 | 177.9° | 177.6° |
| C19 | C20 | C21 | H201 | 120.4° | 121.5° |
| C19 | C20 | C21 | H202 | 120.4° | 122.4° |
| C19 | C20 | H201 | H202 | 118.8° | 118.0° |
| C19 | C20 | C21 | C22 | 163.2° | 176.6° |
| C19 | C20 | C21 | H211 | 76.4° | 54.5° |
| C19 | C20 | C21 | H212 | 42.8° | 61.3° |
| C20 | C19 | C27 | H271 | 2.3° | 178.4° |
| C20 | C19 | C27 | H272 | 122.4° | 58.3° |
| C20 | C19 | C27 | H273 | 117.6° | 61.5° |
| C27 | C19 | C20 | C21 | 66.8° | 95.9° |
| C27 | C19 | C20 | H201 | 53.6° | 142.7° |
| C27 | C19 | C20 | H202 | 172.9° | 26.2° |
| C19 | C27 | H271 | H272 | 120.0° | 120.7° |
| C19 | C27 | H271 | H273 | 120.0° | 120.5° |
| C19 | C27 | H272 | H273 | 120.0° | 120.0° |
| C21 | C20 | H201 | H202 | 118.8° | 116.9° |
| C20 | C21 | C22 | H211 | 120.4° | 122.0° |
| C20 | C21 | C22 | H212 | 120.4° | 121.8° |
| C20 | C21 | H211 | H212 | 118.7° | 117.0° |
| C20 | C21 | C22 | C23 | 146.3° | 159.5° |
| C20 | C21 | C22 | H22 | 33.7° | 21.3° |
| H201 | C20 | C21 | C22 | 42.9° | 61.9° |
| H201 | C20 | C21 | H211 | 163.3° | 176.1° |
| H201 | C20 | C21 | H212 | 77.6° | 60.2° |
| H202 | C20 | C21 | C22 | 76.4° | 54.1° |
| H202 | C20 | C21 | H211 | 44.0° | 67.9° |
| H202 | C20 | C21 | H212 | 163.2° | 176.2° |
| C22 | C21 | H211 | H212 | 118.7° | 117.7° |
| C21 | C22 | C23 | H22 | 180.0° | 179.2° |
| C21 | C22 | C23 | C24 | 179.0° | 179.6° |
| C21 | C22 | C23 | C25 | 1.2° | 0.8° |
| H211 | C21 | C22 | C23 | 93.3° | 78.4° |
| H211 | C21 | C22 | H22 | 86.7° | 100.7° |
| H212 | C21 | C22 | C23 | 25.9° | 37.8° |
| H212 | C21 | C22 | H22 | 154.1° | 143.1° |
| C22 | C23 | C24 | C25 | 177.9° | 179.7° |
| C22 | C23 | C24 | C28 | 89.2° | 85.7° |
| C22 | C23 | C24 | H241 | 150.2° | 35.8° |
| C22 | C23 | C24 | H242 | 31.4° | 152.2° |
| C22 | C23 | C25 | H251 | 180.0° | 0.3° |
| C22 | C23 | C25 | H252 | 60.0° | 119.9° |
| C22 | C23 | C25 | H253 | 60.0° | 120.3° |
| H22 | C22 | C23 | C24 | 1.0° | 1.2° |
| H22 | C22 | C23 | C25 | 178.9° | 178.4° |
| C23 | C24 | C28 | H241 | 120.6° | 121.8° |
| C23 | C24 | C28 | H242 | 120.6° | 122.5° |
| C23 | C24 | H241 | H242 | 118.2° | 117.8° |
| C24 | C23 | C25 | H251 | 2.1° | 179.4° |
| C24 | C23 | C25 | H252 | 122.1° | 60.5° |
| C24 | C23 | C25 | H253 | 117.9° | 59.4° |
| C23 | C24 | C28 | C29 | 173.5° | 176.0° |
| C23 | C24 | C28 | H281 | 53.1° | 53.9° |
| C23 | C24 | C28 | H282 | 66.1° | 61.8° |
| C25 | C23 | C24 | C28 | 92.9° | 94.6° |
| C25 | C23 | C24 | H241 | 27.7° | 143.8° |
| C25 | C23 | C24 | H242 | 146.5° | 27.5° |
| C23 | C25 | H251 | H252 | 120.0° | 120.7° |
| C23 | C25 | H251 | H253 | 120.0° | 120.5° |
| C23 | C25 | H252 | H253 | 120.0° | 120.1° |
| C28 | C24 | H241 | H242 | 118.2° | 116.7° |
| C24 | C28 | C29 | H281 | 120.4° | 122.1° |
| C24 | C28 | C29 | H282 | 120.4° | 122.0° |
| C24 | C28 | H281 | H282 | 118.8° | 117.0° |
| C24 | C28 | C29 | C30 | 179.2° | 168.6° |
| C24 | C28 | C29 | H29 | 0.8° | 12.1° |
| H241 | C24 | C28 | C29 | 65.9° | 62.2° |
| H241 | C24 | C28 | H281 | 173.7° | 175.7° |
| H241 | C24 | C28 | H282 | 54.5° | 60.0° |
| H242 | C24 | C28 | C29 | 52.9° | 53.6° |
| H242 | C24 | C28 | H281 | 67.5° | 68.6° |
| H242 | C24 | C28 | H282 | 173.3° | 175.7° |
| H251 | C25 | H252 | H253 | 120.0° | 118.6° |
| H261 | C26 | H262 | H263 | 120.0° | 118.7° |
| H271 | C27 | H272 | H273 | 120.0° | 118.6° |
| C29 | C28 | H281 | H282 | 118.8° | 117.5° |
| C28 | C29 | C30 | H29 | 180.0° | 179.3° |
| C28 | C29 | C30 | C31 | 179.8° | 178.4° |
| C28 | C29 | C30 | C32 | 0.3° | 2.0° |
| H281 | C28 | C29 | C30 | 58.8° | 69.3° |
| H281 | C28 | C29 | H29 | 121.2° | 110.0° |
| H282 | C28 | C29 | C30 | 60.4° | 46.7° |
| H282 | C28 | C29 | H29 | 119.6° | 134.1° |
| C29 | C30 | C31 | C32 | 179.9° | 179.6° |
| C29 | C30 | C31 | H311 | 180.0° | 1.2° |
| C29 | C30 | C31 | H312 | 60.0° | 118.8° |
| C29 | C30 | C31 | H313 | 60.0° | 121.1° |
| C29 | C30 | C32 | H321 | 180.0° | 0.2° |
| C29 | C30 | C32 | H322 | 60.0° | 119.9° |
| C29 | C30 | C32 | H323 | 60.0° | 120.1° |
| H29 | C29 | C30 | C31 | 0.2° | 2.3° |
| H29 | C29 | C30 | C32 | 179.7° | 177.3° |
| C30 | C31 | H311 | H312 | 120.0° | 120.6° |
| C30 | C31 | H311 | H313 | 120.0° | 120.6° |
| C30 | C31 | H312 | H313 | 120.0° | 120.4° |
| C31 | C30 | C32 | H321 | 0.1° | 179.4° |
| C31 | C30 | C32 | H322 | 120.1° | 60.5° |
| C31 | C30 | C32 | H323 | 119.9° | 59.5° |
| C32 | C30 | C31 | H311 | 0.1° | 179.2° |
| C32 | C30 | C31 | H312 | 119.9° | 60.8° |
| C32 | C30 | C31 | H313 | 120.1° | 59.2° |
| C30 | C32 | H321 | H322 | 120.0° | 120.7° |
| C30 | C32 | H321 | H323 | 120.0° | 120.5° |
| C30 | C32 | H322 | H323 | 120.0° | 120.3° |
| H311 | C31 | H312 | H313 | 120.0° | 118.6° |
| H321 | C32 | H322 | H323 | 120.0° | 118.5° |
