BLR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CMB | C2B | sing | 1.51Å | 1.52Å | |
| CAB | CBB | doub | 1.33Å | 1.37Å | |
| CAB | C3B | sing | 1.47Å | 1.48Å | |
| C2B | C3B | doub | 1.39Å | 1.28Å | |
| C2B | C1B | sing | 1.40Å | 1.41Å | |
| C3B | C4B | sing | 1.46Å | 1.52Å | |
| CMA | C3A | sing | 1.51Å | 1.50Å | |
| CHB | C1B | doub | 1.38Å | 1.37Å | |
| CHB | C4A | sing | 1.41Å | 1.47Å | |
| C1B | NB | sing | 1.39Å | 1.41Å | |
| C4B | NB | sing | 1.35Å | 1.52Å | |
| C4B | OB | doub | 1.22Å | 1.18Å | |
| C3A | C4A | doub | 1.39Å | 1.39Å | Aromatic |
| C3A | C2A | sing | 1.40Å | 1.40Å | Aromatic |
| C4A | NA | sing | 1.38Å | 1.35Å | Aromatic |
| C2A | CAA | sing | 1.51Å | 1.50Å | |
| C2A | C1A | doub | 1.36Å | 1.39Å | Aromatic |
| CAA | CBA | sing | 1.53Å | 1.48Å | |
| O2A | CGA | doub | 1.21Å | 1.28Å | |
| NA | C1A | sing | 1.36Å | 1.36Å | Aromatic |
| CBA | CGA | sing | 1.51Å | 1.49Å | |
| CGA | O1A | sing | 1.34Å | 1.27Å | |
| C1A | CHA | sing | 1.51Å | 1.52Å | |
| CHA | C4D | sing | 1.51Å | 1.41Å | |
| O2D | CGD | doub | 1.21Å | 1.25Å | |
| CAD | C3D | sing | 1.51Å | 1.50Å | |
| CAD | CBD | sing | 1.53Å | 1.52Å | |
| C4D | C3D | doub | 1.36Å | 1.47Å | Aromatic |
| C4D | ND | sing | 1.36Å | 1.43Å | Aromatic |
| C3D | C2D | sing | 1.40Å | 1.37Å | Aromatic |
| CGD | CBD | sing | 1.51Å | 1.49Å | |
| CGD | O1D | sing | 1.34Å | 1.24Å | |
| ND | C1D | sing | 1.38Å | 1.35Å | Aromatic |
| C2D | CMD | sing | 1.51Å | 1.49Å | |
| C2D | C1D | doub | 1.39Å | 1.48Å | Aromatic |
| C1D | CHD | sing | 1.41Å | 1.47Å | |
| CHD | C4C | doub | 1.38Å | 1.36Å | |
| C4C | NC | sing | 1.39Å | 1.44Å | |
| C4C | C3C | sing | 1.47Å | 1.38Å | |
| NC | C1C | sing | 1.34Å | 1.54Å | |
| CAC | C3C | sing | 1.47Å | 1.47Å | |
| CAC | CBC | doub | 1.33Å | 1.36Å | |
| C3C | C2C | doub | 1.39Å | 1.29Å | |
| C1C | C2C | sing | 1.40Å | 1.49Å | |
| C1C | OC | doub | 1.22Å | 1.20Å | |
| C2C | CMC | sing | 1.51Å | 1.49Å | |
| CHA | H1 | sing | 1.09Å | 1.10Å | |
| CHA | H2 | sing | 1.09Å | 1.10Å | |
| NA | H3 | sing | 0.97Å | 1.00Å | |
| CMA | H4 | sing | 1.09Å | 1.10Å | |
| CMA | H5 | sing | 1.09Å | 1.10Å | |
| CMA | H6 | sing | 1.09Å | 1.10Å | |
| CAA | H7 | sing | 1.09Å | 1.10Å | |
| CAA | H8 | sing | 1.09Å | 1.10Å | |
| CBA | H9 | sing | 1.09Å | 1.10Å | |
| CBA | H10 | sing | 1.09Å | 1.10Å | |
| O1A | H11 | sing | 0.97Å | 0.95Å | |
| CHB | H12 | sing | 1.08Å | 1.08Å | |
| NB | H13 | sing | 0.97Å | 1.00Å | |
| CMB | H14 | sing | 1.09Å | 1.10Å | |
| CMB | H15 | sing | 1.09Å | 1.10Å | |
| CMB | H16 | sing | 1.09Å | 1.10Å | |
| CAB | H17 | sing | 1.08Å | 1.08Å | |
| CBB | H18 | sing | 1.08Å | 1.08Å | |
| CBB | H19 | sing | 1.08Å | 1.08Å | |
| NC | H20 | sing | 0.97Å | 1.00Å | |
| CMC | H21 | sing | 1.09Å | 1.10Å | |
| CMC | H22 | sing | 1.09Å | 1.10Å | |
| CMC | H23 | sing | 1.09Å | 1.10Å | |
| CAC | H24 | sing | 1.08Å | 1.08Å | |
| CBC | H25 | sing | 1.08Å | 1.08Å | |
| CBC | H26 | sing | 1.08Å | 1.08Å | |
| CHD | H27 | sing | 1.08Å | 1.08Å | |
| ND | H28 | sing | 0.97Å | 1.00Å | |
| CMD | H29 | sing | 1.09Å | 1.10Å | |
| CMD | H30 | sing | 1.09Å | 1.10Å | |
| CMD | H31 | sing | 1.09Å | 1.10Å | |
| CAD | H32 | sing | 1.09Å | 1.10Å | |
| CAD | H33 | sing | 1.09Å | 1.10Å | |
| CBD | H34 | sing | 1.09Å | 1.10Å | |
| CBD | H35 | sing | 1.09Å | 1.10Å | |
| O1D | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CMB | C2B | C3B | 126.2° | 126.3° |
| CMB | C2B | C1B | 122.4° | 126.2° |
| C2B | CMB | H14 | 109.5° | 109.5° |
| C2B | CMB | H15 | 109.5° | 109.5° |
| C2B | CMB | H16 | 109.5° | 109.5° |
| CBB | CAB | C3B | 124.4° | 120.0° |
| CBB | CAB | H17 | 117.8° | 120.0° |
| CAB | CBB | H18 | 120.0° | 120.0° |
| CAB | CBB | H19 | 120.0° | 120.0° |
| CAB | C3B | C2B | 127.8° | 126.6° |
| CAB | C3B | C4B | 120.0° | 126.7° |
| C3B | CAB | H17 | 117.8° | 120.0° |
| C3B | C2B | C1B | 111.4° | 107.5° |
| C2B | C3B | C4B | 112.2° | 106.7° |
| C2B | C1B | CHB | 127.8° | 125.5° |
| C2B | C1B | NB | 108.4° | 108.9° |
| C3B | C4B | NB | 99.9° | 107.7° |
| C3B | C4B | OB | 135.0° | 126.2° |
| CMA | C3A | C4A | 125.8° | 126.5° |
| CMA | C3A | C2A | 126.6° | 126.5° |
| C3A | CMA | H4 | 109.5° | 109.5° |
| C3A | CMA | H5 | 109.4° | 109.4° |
| C3A | CMA | H6 | 109.5° | 109.5° |
| C1B | CHB | C4A | 129.2° | 120.0° |
| CHB | C1B | NB | 123.8° | 125.5° |
| C1B | CHB | H12 | 115.4° | 120.0° |
| CHB | C4A | C3A | 124.3° | 126.3° |
| CHB | C4A | NA | 127.4° | 126.3° |
| C4A | CHB | H12 | 115.4° | 120.0° |
| C1B | NB | C4B | 108.1° | 109.2° |
| C1B | NB | H13 | 125.9° | 125.4° |
| NB | C4B | OB | 125.1° | 126.1° |
| C4B | NB | H13 | 125.9° | 125.4° |
| C4A | C3A | C2A | 107.6° | 107.0° |
| C3A | C4A | NA | 108.3° | 107.4° |
| C3A | C2A | CAA | 127.4° | 126.0° |
| C3A | C2A | C1A | 106.4° | 108.0° |
| C4A | NA | C1A | 108.7° | 108.6° |
| C4A | NA | H3 | 125.7° | 125.7° |
| CAA | C2A | C1A | 126.2° | 126.0° |
| C2A | CAA | CBA | 113.0° | 109.5° |
| C2A | CAA | H7 | 108.6° | 109.5° |
| C2A | CAA | H8 | 108.6° | 109.5° |
| C2A | C1A | NA | 109.1° | 108.9° |
| C2A | C1A | CHA | 127.8° | 125.5° |
| CAA | CBA | CGA | 113.5° | 109.5° |
| CBA | CAA | H7 | 108.6° | 109.4° |
| CBA | CAA | H8 | 108.6° | 109.5° |
| CAA | CBA | H9 | 108.5° | 109.4° |
| CAA | CBA | H10 | 108.4° | 109.4° |
| O2A | CGA | CBA | 116.3° | 120.0° |
| O2A | CGA | O1A | 122.4° | 120.0° |
| NA | C1A | CHA | 122.9° | 125.5° |
| C1A | NA | H3 | 125.6° | 125.6° |
| CBA | CGA | O1A | 121.3° | 120.0° |
| CGA | CBA | H9 | 108.4° | 109.5° |
| CGA | CBA | H10 | 108.5° | 109.5° |
| CGA | O1A | H11 | 109.5° | 117.0° |
| C1A | CHA | C4D | 105.9° | 109.5° |
| C1A | CHA | H1 | 110.4° | 109.5° |
| C1A | CHA | H2 | 110.4° | 109.5° |
| CHA | C4D | C3D | 131.8° | 125.5° |
| CHA | C4D | ND | 123.6° | 125.6° |
| C4D | CHA | H1 | 110.3° | 109.5° |
| C4D | CHA | H2 | 110.3° | 109.4° |
| O2D | CGD | CBD | 121.5° | 120.0° |
| O2D | CGD | O1D | 119.4° | 120.0° |
| C3D | CAD | CBD | 110.5° | 109.5° |
| CAD | C3D | C4D | 126.3° | 126.0° |
| CAD | C3D | C2D | 125.2° | 126.0° |
| C3D | CAD | H32 | 109.2° | 109.5° |
| C3D | CAD | H33 | 109.2° | 109.4° |
| CAD | CBD | CGD | 111.0° | 109.5° |
| CBD | CAD | H32 | 109.2° | 109.5° |
| CBD | CAD | H33 | 109.2° | 109.5° |
| CAD | CBD | H34 | 109.1° | 109.4° |
| CAD | CBD | H35 | 109.1° | 109.4° |
| C3D | C4D | ND | 104.5° | 108.9° |
| C4D | C3D | C2D | 108.5° | 107.9° |
| C4D | ND | C1D | 111.9° | 108.6° |
| C4D | ND | H28 | 124.0° | 125.7° |
| C3D | C2D | CMD | 128.9° | 126.5° |
| C3D | C2D | C1D | 108.3° | 107.1° |
| CBD | CGD | O1D | 119.0° | 120.0° |
| CGD | CBD | H34 | 109.1° | 109.5° |
| CGD | CBD | H35 | 109.1° | 109.5° |
| CGD | O1D | H36 | 109.5° | 117.0° |
| ND | C1D | C2D | 106.8° | 107.4° |
| ND | C1D | CHD | 130.6° | 126.3° |
| C1D | ND | H28 | 124.0° | 125.7° |
| CMD | C2D | C1D | 122.8° | 126.5° |
| C2D | CMD | H29 | 109.5° | 109.4° |
| C2D | CMD | H30 | 109.5° | 109.5° |
| C2D | CMD | H31 | 109.5° | 109.4° |
| C2D | C1D | CHD | 122.7° | 126.3° |
| C1D | CHD | C4C | 126.9° | 120.0° |
| C1D | CHD | H27 | 116.5° | 120.0° |
| CHD | C4C | NC | 123.2° | 126.7° |
| CHD | C4C | C3C | 129.1° | 126.6° |
| C4C | CHD | H27 | 116.5° | 120.0° |
| NC | C4C | C3C | 107.7° | 106.7° |
| C4C | NC | C1C | 106.7° | 109.2° |
| C4C | NC | H20 | 126.6° | 125.4° |
| C4C | C3C | CAC | 120.7° | 127.0° |
| C4C | C3C | C2C | 112.9° | 106.0° |
| NC | C1C | C2C | 100.7° | 110.1° |
| NC | C1C | OC | 126.2° | 125.0° |
| C1C | NC | H20 | 126.7° | 125.4° |
| C3C | CAC | CBC | 123.0° | 119.9° |
| CAC | C3C | C2C | 126.4° | 127.0° |
| C3C | CAC | H24 | 118.5° | 120.0° |
| CBC | CAC | H24 | 118.5° | 120.0° |
| CAC | CBC | H25 | 120.0° | 119.9° |
| CAC | CBC | H26 | 120.0° | 120.0° |
| C3C | C2C | C1C | 112.0° | 108.1° |
| C3C | C2C | CMC | 128.4° | 126.0° |
| C2C | C1C | OC | 133.1° | 125.0° |
| C1C | C2C | CMC | 119.6° | 126.0° |
| C2C | CMC | H21 | 109.5° | 109.4° |
| C2C | CMC | H22 | 109.4° | 109.5° |
| C2C | CMC | H23 | 109.5° | 109.5° |
| H1 | CHA | H2 | 109.5° | 109.5° |
| H4 | CMA | H5 | 109.5° | 109.5° |
| H4 | CMA | H6 | 109.5° | 109.5° |
| H5 | CMA | H6 | 109.5° | 109.5° |
| H7 | CAA | H8 | 109.4° | 109.4° |
| H9 | CBA | H10 | 109.5° | 109.5° |
| H14 | CMB | H15 | 109.4° | 109.4° |
| H14 | CMB | H16 | 109.5° | 109.5° |
| H15 | CMB | H16 | 109.5° | 109.4° |
| H18 | CBB | H19 | 120.0° | 120.0° |
| H21 | CMC | H22 | 109.5° | 109.5° |
| H21 | CMC | H23 | 109.5° | 109.4° |
| H22 | CMC | H23 | 109.5° | 109.5° |
| H25 | CBC | H26 | 120.0° | 120.0° |
| H29 | CMD | H30 | 109.5° | 109.5° |
| H29 | CMD | H31 | 109.4° | 109.5° |
| H30 | CMD | H31 | 109.4° | 109.5° |
| H32 | CAD | H33 | 109.5° | 109.4° |
| H34 | CBD | H35 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CMB | C2B | C3B | CAB | 0.1° | 0.1° |
| CMB | C2B | C3B | C1B | 179.0° | 179.8° |
| CMB | C2B | C3B | C4B | 179.0° | 180.0° |
| CMB | C2B | C1B | CHB | 1.2° | 0.1° |
| CMB | C2B | C1B | NB | 179.6° | 179.8° |
| C2B | CMB | H14 | H15 | 120.0° | 120.0° |
| C2B | CMB | H14 | H16 | 120.0° | 120.0° |
| C2B | CMB | H15 | H16 | 120.0° | 120.0° |
| CBB | CAB | C3B | H17 | 180.0° | 180.0° |
| CBB | CAB | C3B | C2B | 179.3° | 180.0° |
| CBB | CAB | C3B | C4B | 0.3° | 0.2° |
| CAB | CBB | H18 | H19 | 180.0° | 180.0° |
| CAB | C3B | C2B | C4B | 179.1° | 179.8° |
| CAB | C3B | C2B | C1B | 178.9° | 180.0° |
| CAB | C3B | C4B | NB | 179.1° | 179.8° |
| CAB | C3B | C4B | OB | 0.6° | 0.2° |
| C3B | CAB | CBB | H18 | 180.0° | 0.0° |
| C3B | CAB | CBB | H19 | 0.0° | 180.0° |
| C3B | C2B | C1B | CHB | 179.8° | 180.0° |
| C3B | C2B | C1B | NB | 1.3° | 0.1° |
| C2B | C3B | C4B | NB | 1.7° | 0.4° |
| C2B | C3B | C4B | OB | 179.7° | 180.0° |
| C3B | C2B | CMB | H14 | 180.0° | 0.0° |
| C3B | C2B | CMB | H15 | 60.0° | 120.0° |
| C3B | C2B | CMB | H16 | 60.0° | 120.0° |
| C2B | C3B | CAB | H17 | 0.7° | 0.0° |
| C1B | C2B | C3B | C4B | 2.0° | 0.2° |
| C2B | C1B | CHB | NB | 178.2° | 179.9° |
| C2B | C1B | CHB | C4A | 179.9° | 171.3° |
| C2B | C1B | NB | C4B | 0.2° | 0.3° |
| C2B | C1B | CHB | H12 | 0.2° | 8.8° |
| C2B | C1B | NB | H13 | 179.8° | 180.0° |
| C1B | C2B | CMB | H14 | 1.1° | 179.8° |
| C1B | C2B | CMB | H15 | 121.1° | 59.8° |
| C1B | C2B | CMB | H16 | 118.9° | 60.2° |
| C3B | C4B | NB | C1B | 0.8° | 0.4° |
| C3B | C4B | NB | OB | 178.7° | 179.6° |
| C3B | C4B | NB | H13 | 179.2° | 179.9° |
| C4B | C3B | CAB | H17 | 179.7° | 179.8° |
| CMA | C3A | C4A | CHB | 0.1° | 0.4° |
| CMA | C3A | C4A | C2A | 179.0° | 179.6° |
| CMA | C3A | C4A | NA | 179.4° | 180.0° |
| CMA | C3A | C2A | CAA | 0.4° | 0.1° |
| CMA | C3A | C2A | C1A | 179.7° | 179.9° |
| C3A | CMA | H4 | H5 | 120.0° | 120.0° |
| C3A | CMA | H4 | H6 | 120.0° | 120.0° |
| C3A | CMA | H5 | H6 | 120.0° | 120.0° |
| C1B | CHB | C4A | H12 | 180.0° | 179.9° |
| CHB | C1B | NB | C4B | 178.7° | 179.8° |
| C1B | CHB | C4A | C3A | 162.5° | 162.5° |
| C1B | CHB | C4A | NA | 16.9° | 18.1° |
| CHB | C1B | NB | H13 | 1.3° | 0.1° |
| C4A | CHB | C1B | NB | 1.6° | 8.6° |
| CHB | C4A | C3A | NA | 179.5° | 179.5° |
| CHB | C4A | C3A | C2A | 179.1° | 180.0° |
| CHB | C4A | NA | C1A | 179.5° | 179.9° |
| CHB | C4A | NA | H3 | 0.5° | 0.3° |
| C1B | NB | C4B | H13 | 180.0° | 179.7° |
| C1B | NB | C4B | OB | 179.6° | 180.0° |
| NB | C1B | CHB | H12 | 178.4° | 171.3° |
| OB | C4B | NB | H13 | 0.4° | 0.3° |
| C4A | C3A | C2A | CAA | 178.6° | 179.7° |
| C4A | C3A | C2A | C1A | 0.7° | 0.3° |
| C3A | C4A | NA | C1A | 0.0° | 0.4° |
| C3A | C4A | NA | H3 | 180.0° | 179.8° |
| C4A | C3A | CMA | H4 | 89.4° | 90.0° |
| C4A | C3A | CMA | H5 | 150.6° | 150.0° |
| C4A | C3A | CMA | H6 | 30.6° | 30.1° |
| C3A | C4A | CHB | H12 | 17.5° | 17.4° |
| C2A | C3A | C4A | NA | 0.4° | 0.4° |
| C3A | C2A | CAA | C1A | 179.1° | 180.0° |
| C3A | C2A | CAA | CBA | 78.0° | 90.0° |
| C3A | C2A | C1A | NA | 0.7° | 0.1° |
| C3A | C2A | C1A | CHA | 173.6° | 180.0° |
| C2A | C3A | CMA | H4 | 89.4° | 90.5° |
| C2A | C3A | CMA | H5 | 30.6° | 29.5° |
| C2A | C3A | CMA | H6 | 150.6° | 149.5° |
| C3A | C2A | CAA | H7 | 42.5° | 30.0° |
| C3A | C2A | CAA | H8 | 161.4° | 150.0° |
| C4A | NA | C1A | C2A | 0.4° | 0.2° |
| C4A | NA | C1A | H3 | 180.0° | 179.8° |
| C4A | NA | C1A | CHA | 174.2° | 179.7° |
| NA | C4A | CHB | H12 | 163.1° | 162.0° |
| C2A | CAA | CBA | H7 | 120.5° | 120.0° |
| C2A | CAA | CBA | H8 | 120.6° | 120.1° |
| CAA | C2A | C1A | NA | 178.6° | 180.0° |
| C2A | CAA | CBA | CGA | 178.5° | 180.0° |
| CAA | C2A | C1A | CHA | 7.1° | 0.0° |
| C2A | CAA | H7 | H8 | 118.3° | 120.0° |
| C2A | CAA | CBA | H9 | 60.9° | 60.0° |
| C2A | CAA | CBA | H10 | 57.9° | 60.0° |
| C1A | C2A | CAA | CBA | 102.9° | 90.0° |
| C2A | C1A | NA | CHA | 174.6° | 179.9° |
| C2A | C1A | CHA | C4D | 60.8° | 85.0° |
| C2A | C1A | CHA | H1 | 58.6° | 154.9° |
| C2A | C1A | CHA | H2 | 179.8° | 34.9° |
| C2A | C1A | NA | H3 | 179.6° | 180.0° |
| C1A | C2A | CAA | H7 | 136.6° | 149.9° |
| C1A | C2A | CAA | H8 | 17.7° | 30.0° |
| CAA | CBA | CGA | O2A | 152.4° | 0.0° |
| CAA | CBA | CGA | H9 | 120.6° | 120.0° |
| CAA | CBA | CGA | H10 | 120.6° | 120.0° |
| CAA | CBA | CGA | O1A | 25.7° | 180.0° |
| CBA | CAA | H7 | H8 | 118.4° | 119.9° |
| CAA | CBA | H9 | H10 | 118.1° | 120.0° |
| O2A | CGA | CBA | O1A | 178.0° | 180.0° |
| O2A | CGA | CBA | H9 | 87.0° | 120.0° |
| O2A | CGA | CBA | H10 | 31.8° | 120.0° |
| O2A | CGA | O1A | H11 | 0.0° | 0.0° |
| NA | C1A | CHA | C4D | 112.8° | 95.1° |
| NA | C1A | CHA | H1 | 127.8° | 25.0° |
| NA | C1A | CHA | H2 | 6.7° | 145.0° |
| CGA | CBA | CAA | H7 | 57.9° | 60.0° |
| CGA | CBA | CAA | H8 | 61.0° | 59.9° |
| CGA | CBA | H9 | H10 | 118.2° | 120.0° |
| CBA | CGA | O1A | H11 | 177.9° | 180.0° |
| O1A | CGA | CBA | H9 | 94.9° | 60.0° |
| O1A | CGA | CBA | H10 | 146.2° | 60.0° |
| C1A | CHA | C4D | H1 | 119.4° | 120.1° |
| C1A | CHA | C4D | H2 | 119.4° | 120.0° |
| C1A | CHA | C4D | C3D | 57.5° | 85.0° |
| C1A | CHA | C4D | ND | 116.3° | 95.4° |
| C1A | CHA | H1 | H2 | 121.7° | 120.0° |
| CHA | C1A | NA | H3 | 5.8° | 0.1° |
| CHA | C4D | C3D | CAD | 4.4° | 0.2° |
| CHA | C4D | C3D | ND | 174.7° | 179.6° |
| CHA | C4D | C3D | C2D | 172.7° | 180.0° |
| CHA | C4D | ND | C1D | 173.5° | 179.9° |
| C4D | CHA | H1 | H2 | 121.6° | 120.0° |
| CHA | C4D | ND | H28 | 6.5° | 0.2° |
| O2D | CGD | CBD | CAD | 60.8° | 0.0° |
| O2D | CGD | CBD | O1D | 177.8° | 180.0° |
| O2D | CGD | CBD | H34 | 59.5° | 120.0° |
| O2D | CGD | CBD | H35 | 179.0° | 120.0° |
| O2D | CGD | O1D | H36 | 0.0° | 0.0° |
| C3D | CAD | CBD | H32 | 120.2° | 120.0° |
| C3D | CAD | CBD | H33 | 120.2° | 120.0° |
| CAD | C3D | C4D | C2D | 177.1° | 179.7° |
| CAD | C3D | C4D | ND | 179.1° | 179.9° |
| C3D | CAD | CBD | CGD | 83.1° | 180.0° |
| CAD | C3D | C2D | CMD | 2.7° | 0.0° |
| CAD | C3D | C2D | C1D | 178.7° | 179.9° |
| C3D | CAD | H32 | H33 | 119.5° | 119.9° |
| C3D | CAD | CBD | H34 | 156.6° | 60.0° |
| C3D | CAD | CBD | H35 | 37.1° | 60.0° |
| CBD | CAD | C3D | C4D | 82.6° | 89.7° |
| CBD | CAD | C3D | C2D | 100.7° | 90.0° |
| CAD | CBD | CGD | H34 | 120.3° | 120.0° |
| CAD | CBD | CGD | H35 | 120.2° | 120.0° |
| CAD | CBD | CGD | O1D | 121.4° | 180.0° |
| CBD | CAD | H32 | H33 | 119.6° | 120.0° |
| CAD | CBD | H34 | H35 | 119.3° | 120.0° |
| C3D | C4D | ND | C1D | 1.7° | 0.4° |
| C4D | C3D | C2D | CMD | 179.9° | 179.8° |
| C4D | C3D | C2D | C1D | 1.5° | 0.2° |
| C3D | C4D | CHA | H1 | 177.0° | 35.0° |
| C3D | C4D | CHA | H2 | 61.9° | 155.0° |
| C3D | C4D | ND | H28 | 178.3° | 179.9° |
| C4D | C3D | CAD | H32 | 37.6° | 30.3° |
| C4D | C3D | CAD | H33 | 157.2° | 150.3° |
| ND | C4D | C3D | C2D | 1.9° | 0.4° |
| C4D | ND | C1D | H28 | 180.0° | 179.7° |
| C4D | ND | C1D | C2D | 0.9° | 0.3° |
| C4D | ND | C1D | CHD | 178.4° | 179.8° |
| ND | C4D | CHA | H1 | 3.2° | 144.6° |
| ND | C4D | CHA | H2 | 124.3° | 24.6° |
| C3D | C2D | C1D | ND | 0.4° | 0.1° |
| C3D | C2D | CMD | C1D | 178.5° | 179.9° |
| C3D | C2D | C1D | CHD | 179.8° | 180.0° |
| C3D | C2D | CMD | H29 | 90.8° | 90.0° |
| C3D | C2D | CMD | H30 | 149.2° | 30.0° |
| C3D | C2D | CMD | H31 | 29.2° | 150.1° |
| C2D | C3D | CAD | H32 | 139.1° | 150.0° |
| C2D | C3D | CAD | H33 | 19.4° | 30.0° |
| CGD | CBD | CAD | H32 | 37.0° | 60.0° |
| CGD | CBD | CAD | H33 | 156.7° | 60.0° |
| CGD | CBD | H34 | H35 | 119.3° | 120.0° |
| CBD | CGD | O1D | H36 | 177.8° | 180.0° |
| O1D | CGD | CBD | H34 | 118.3° | 60.0° |
| O1D | CGD | CBD | H35 | 1.2° | 60.0° |
| ND | C1D | C2D | CMD | 179.1° | 180.0° |
| ND | C1D | C2D | CHD | 179.4° | 179.9° |
| ND | C1D | CHD | C4C | 6.2° | 15.7° |
| ND | C1D | CHD | H27 | 173.8° | 164.4° |
| CMD | C2D | C1D | CHD | 1.5° | 0.1° |
| C2D | CMD | H29 | H30 | 120.0° | 120.0° |
| C2D | CMD | H29 | H31 | 120.0° | 119.9° |
| C2D | CMD | H30 | H31 | 120.0° | 120.0° |
| C2D | C1D | CHD | C4C | 174.6° | 164.2° |
| C2D | C1D | CHD | H27 | 5.4° | 15.7° |
| C2D | C1D | ND | H28 | 179.1° | 180.0° |
| C1D | C2D | CMD | H29 | 90.7° | 90.0° |
| C1D | C2D | CMD | H30 | 29.3° | 150.0° |
| C1D | C2D | CMD | H31 | 149.3° | 30.0° |
| C1D | CHD | C4C | H27 | 180.0° | 179.9° |
| C1D | CHD | C4C | NC | 9.6° | 5.4° |
| C1D | CHD | C4C | C3C | 170.9° | 175.0° |
| CHD | C1D | ND | H28 | 1.6° | 0.1° |
| CHD | C4C | NC | C3C | 179.6° | 179.7° |
| CHD | C4C | NC | C1C | 179.2° | 179.9° |
| CHD | C4C | C3C | CAC | 1.8° | 0.2° |
| CHD | C4C | C3C | C2C | 179.6° | 179.9° |
| CHD | C4C | NC | H20 | 0.8° | 0.2° |
| C4C | NC | C1C | H20 | 180.0° | 179.7° |
| NC | C4C | C3C | CAC | 178.6° | 179.9° |
| NC | C4C | C3C | C2C | 0.8° | 0.4° |
| C4C | NC | C1C | C2C | 1.1° | 0.3° |
| C4C | NC | C1C | OC | 179.1° | 179.8° |
| NC | C4C | CHD | H27 | 170.4° | 174.5° |
| C3C | C4C | NC | C1C | 1.2° | 0.4° |
| C4C | C3C | CAC | C2C | 177.5° | 179.7° |
| C4C | C3C | CAC | CBC | 144.4° | 129.6° |
| C4C | C3C | C2C | C1C | 0.0° | 0.2° |
| C4C | C3C | C2C | CMC | 177.7° | 179.8° |
| C3C | C4C | NC | H20 | 178.8° | 179.8° |
| C4C | C3C | CAC | H24 | 35.6° | 50.5° |
| C3C | C4C | CHD | H27 | 9.1° | 5.1° |
| NC | C1C | C2C | C3C | 0.7° | 0.0° |
| NC | C1C | C2C | OC | 177.8° | 179.9° |
| NC | C1C | C2C | CMC | 178.6° | 180.0° |
| C3C | CAC | CBC | H24 | 180.0° | 179.9° |
| CAC | C3C | C2C | C1C | 177.7° | 180.0° |
| CAC | C3C | C2C | CMC | 0.0° | 0.0° |
| C3C | CAC | CBC | H25 | 180.0° | 176.3° |
| C3C | CAC | CBC | H26 | 0.0° | 3.5° |
| CBC | CAC | C3C | C2C | 38.1° | 50.8° |
| CAC | CBC | H25 | H26 | 180.0° | 179.9° |
| C3C | C2C | C1C | CMC | 177.9° | 180.0° |
| C3C | C2C | C1C | OC | 178.5° | 179.9° |
| C3C | C2C | CMC | H21 | 180.0° | 180.0° |
| C3C | C2C | CMC | H22 | 60.0° | 60.0° |
| C3C | C2C | CMC | H23 | 60.0° | 60.1° |
| C2C | C3C | CAC | H24 | 141.9° | 129.2° |
| C2C | C1C | NC | H20 | 178.8° | 180.0° |
| C1C | C2C | CMC | H21 | 2.5° | 0.0° |
| C1C | C2C | CMC | H22 | 122.5° | 120.0° |
| C1C | C2C | CMC | H23 | 117.5° | 119.9° |
| OC | C1C | C2C | CMC | 3.6° | 0.1° |
| OC | C1C | NC | H20 | 0.8° | 0.1° |
| C2C | CMC | H21 | H22 | 120.0° | 120.0° |
| C2C | CMC | H21 | H23 | 120.0° | 119.9° |
| C2C | CMC | H22 | H23 | 120.0° | 120.0° |
| H4 | CMA | H5 | H6 | 120.0° | 120.0° |
| H7 | CAA | CBA | H9 | 178.5° | 180.0° |
| H7 | CAA | CBA | H10 | 62.7° | 60.1° |
| H8 | CAA | CBA | H9 | 59.6° | 60.1° |
| H8 | CAA | CBA | H10 | 178.4° | 179.9° |
| H14 | CMB | H15 | H16 | 120.0° | 120.0° |
| H17 | CAB | CBB | H18 | 0.0° | NaN° |
| H17 | CAB | CBB | H19 | 180.0° | 0.0° |
| H21 | CMC | H22 | H23 | 120.0° | 120.0° |
| H24 | CAC | CBC | H25 | 0.0° | 3.7° |
| H24 | CAC | CBC | H26 | 180.0° | 176.4° |
| H29 | CMD | H30 | H31 | 119.9° | 120.0° |
| H32 | CAD | CBD | H34 | 83.2° | 180.0° |
| H32 | CAD | CBD | H35 | 157.2° | 60.0° |
| H33 | CAD | CBD | H34 | 36.5° | 60.0° |
| H33 | CAD | CBD | H35 | 83.1° | 180.0° |
