PXQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OB | C4B | doub | 1.22Å | 0.00Å | |
| CBB | CAB | sing | 1.53Å | 0.00Å | |
| CAB | C3B | sing | 1.51Å | 0.00Å | |
| C4B | C3B | sing | 1.41Å | 0.00Å | |
| C4B | NB | sing | 1.35Å | 0.00Å | |
| C3B | C2B | doub | 1.36Å | 0.00Å | |
| NB | C1B | sing | 1.39Å | 0.00Å | |
| C2B | C1B | sing | 1.41Å | 0.00Å | |
| C2B | CMB | sing | 1.51Å | 0.00Å | |
| C1B | CHB | doub | 1.38Å | 0.00Å | |
| CMA | C3A | sing | 1.51Å | 0.00Å | |
| O1A | CGA | doub | 1.21Å | 0.00Å | |
| CHB | C4A | sing | 1.41Å | 0.00Å | |
| O2A | CGA | sing | 1.34Å | 0.00Å | |
| C3A | C4A | doub | 1.39Å | 0.00Å | Aromatic |
| C3A | C2A | sing | 1.40Å | 0.00Å | Aromatic |
| CGA | CBA | sing | 1.51Å | 0.00Å | |
| C4A | NA | sing | 1.38Å | 0.00Å | Aromatic |
| C2A | CAA | sing | 1.51Å | 0.00Å | |
| C2A | C1A | doub | 1.36Å | 0.00Å | Aromatic |
| CAA | CBA | sing | 1.53Å | 0.00Å | |
| NA | C1A | sing | 1.36Å | 0.00Å | Aromatic |
| C1A | CHA | sing | 1.51Å | 0.00Å | |
| CHA | C4D | sing | 1.51Å | 0.00Å | |
| C4D | ND | sing | 1.36Å | 0.00Å | Aromatic |
| C4D | C3D | doub | 1.35Å | 0.00Å | Aromatic |
| ND | C1D | sing | 1.36Å | 0.00Å | Aromatic |
| C1D | CHD | sing | 1.51Å | 0.00Å | |
| C1D | C2D | doub | 1.35Å | 0.00Å | Aromatic |
| C3D | CAD | sing | 1.51Å | 0.00Å | |
| C3D | C2D | sing | 1.41Å | 0.00Å | Aromatic |
| CHD | C4C | sing | 1.51Å | 0.00Å | |
| CAD | CBD | sing | 1.53Å | 0.00Å | |
| O2D | CGD | doub | 1.21Å | 0.00Å | |
| C2D | CMD | sing | 1.51Å | 0.00Å | |
| CBC | CAC | sing | 1.53Å | 0.00Å | |
| CBD | CGD | sing | 1.51Å | 0.00Å | |
| CAC | C3C | sing | 1.53Å | 0.00Å | |
| CGD | O1D | sing | 1.34Å | 0.00Å | |
| C4C | C3C | sing | 1.51Å | 0.00Å | |
| C4C | NC | doub | 1.29Å | 0.00Å | |
| C3C | C2C | sing | 1.54Å | 0.00Å | |
| NC | C1C | sing | 1.34Å | 0.00Å | |
| C2C | CMC | sing | 1.53Å | 0.00Å | |
| C2C | C1C | sing | 1.52Å | 0.00Å | |
| C1C | OC | doub | 1.21Å | 0.00Å | |
| CHA | H1 | sing | 1.09Å | 0.00Å | |
| CHA | H2 | sing | 1.09Å | 0.00Å | |
| NA | H3 | sing | 0.97Å | 0.00Å | |
| CMA | H4 | sing | 1.09Å | 0.00Å | |
| CMA | H5 | sing | 1.09Å | 0.00Å | |
| CMA | H6 | sing | 1.09Å | 0.00Å | |
| CAA | H7 | sing | 1.09Å | 0.00Å | |
| CAA | H8 | sing | 1.09Å | 0.00Å | |
| CBA | H9 | sing | 1.09Å | 0.00Å | |
| CBA | H10 | sing | 1.09Å | 0.00Å | |
| O2A | H11 | sing | 0.97Å | 0.00Å | |
| CHB | H12 | sing | 1.08Å | 0.00Å | |
| NB | H13 | sing | 0.97Å | 0.00Å | |
| CMB | H14 | sing | 1.09Å | 0.00Å | |
| CMB | H15 | sing | 1.09Å | 0.00Å | |
| CMB | H16 | sing | 1.09Å | 0.00Å | |
| CAB | H17 | sing | 1.09Å | 0.00Å | |
| CAB | H18 | sing | 1.09Å | 0.00Å | |
| CBB | H19 | sing | 1.09Å | 0.00Å | |
| CBB | H20 | sing | 1.09Å | 0.00Å | |
| CBB | H21 | sing | 1.09Å | 0.00Å | |
| C2C | H22 | sing | 1.09Å | 0.00Å | |
| C3C | H23 | sing | 1.09Å | 0.00Å | |
| CMC | H24 | sing | 1.09Å | 0.00Å | |
| CMC | H25 | sing | 1.09Å | 0.00Å | |
| CMC | H26 | sing | 1.09Å | 0.00Å | |
| CAC | H27 | sing | 1.09Å | 0.00Å | |
| CAC | H28 | sing | 1.09Å | 0.00Å | |
| CBC | H29 | sing | 1.09Å | 0.00Å | |
| CBC | H30 | sing | 1.09Å | 0.00Å | |
| CBC | H31 | sing | 1.09Å | 0.00Å | |
| CHD | H32 | sing | 1.09Å | 0.00Å | |
| CHD | H33 | sing | 1.09Å | 0.00Å | |
| ND | H34 | sing | 0.97Å | 0.00Å | |
| CMD | H35 | sing | 1.09Å | 0.00Å | |
| CMD | H36 | sing | 1.09Å | 0.00Å | |
| CMD | H37 | sing | 1.09Å | 0.00Å | |
| CAD | H38 | sing | 1.09Å | 0.00Å | |
| CAD | H39 | sing | 1.09Å | 0.00Å | |
| CBD | H40 | sing | 1.09Å | 0.00Å | |
| CBD | H41 | sing | 1.09Å | 0.00Å | |
| O1D | H42 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OB | C4B | C3B | 90.0° | 125.6° |
| OB | C4B | NB | 90.0° | 125.7° |
| CBB | CAB | C3B | 90.0° | 109.4° |
| CBB | CAB | H17 | 90.0° | 109.5° |
| CBB | CAB | H18 | 90.0° | 109.4° |
| CAB | CBB | H19 | 90.0° | 109.5° |
| CAB | CBB | H20 | 90.0° | 109.5° |
| CAB | CBB | H21 | 90.0° | 109.5° |
| CAB | C3B | C4B | 90.0° | 126.0° |
| CAB | C3B | C2B | 90.0° | 126.0° |
| C3B | CAB | H17 | 90.0° | 109.5° |
| C3B | CAB | H18 | 90.0° | 109.5° |
| C3B | C4B | NB | 90.0° | 108.7° |
| C4B | C3B | C2B | 90.0° | 108.1° |
| C4B | NB | C1B | 90.0° | 108.3° |
| C4B | NB | H13 | 90.0° | 125.9° |
| C3B | C2B | C1B | 90.0° | 107.4° |
| C3B | C2B | CMB | 90.0° | 126.3° |
| NB | C1B | C2B | 90.0° | 107.5° |
| NB | C1B | CHB | 90.0° | 126.2° |
| C1B | NB | H13 | 90.0° | 125.8° |
| C1B | C2B | CMB | 90.0° | 126.3° |
| C2B | C1B | CHB | 90.0° | 126.2° |
| C2B | CMB | H14 | 90.0° | 109.5° |
| C2B | CMB | H15 | 90.0° | 109.5° |
| C2B | CMB | H16 | 90.0° | 109.5° |
| C1B | CHB | C4A | 90.0° | 120.0° |
| C1B | CHB | H12 | 90.0° | 120.0° |
| CMA | C3A | C4A | 90.0° | 126.5° |
| CMA | C3A | C2A | 90.0° | 126.5° |
| C3A | CMA | H4 | 90.0° | 109.5° |
| C3A | CMA | H5 | 90.0° | 109.5° |
| C3A | CMA | H6 | 90.0° | 109.5° |
| O1A | CGA | O2A | 90.0° | 120.0° |
| O1A | CGA | CBA | 90.0° | 119.9° |
| CHB | C4A | C3A | 90.0° | 126.3° |
| CHB | C4A | NA | 90.0° | 126.3° |
| C4A | CHB | H12 | 90.0° | 120.0° |
| O2A | CGA | CBA | 90.0° | 120.0° |
| CGA | O2A | H11 | 90.0° | 117.0° |
| C4A | C3A | C2A | 90.0° | 107.0° |
| C3A | C4A | NA | 90.0° | 107.4° |
| C3A | C2A | CAA | 90.0° | 126.0° |
| C3A | C2A | C1A | 90.0° | 108.0° |
| CGA | CBA | CAA | 90.0° | 109.5° |
| CGA | CBA | H9 | 90.0° | 109.4° |
| CGA | CBA | H10 | 90.0° | 109.5° |
| C4A | NA | C1A | 90.0° | 108.6° |
| C4A | NA | H3 | 90.0° | 125.7° |
| CAA | C2A | C1A | 90.0° | 126.0° |
| C2A | CAA | CBA | 90.0° | 109.5° |
| C2A | CAA | H7 | 90.0° | 109.5° |
| C2A | CAA | H8 | 90.0° | 109.5° |
| C2A | C1A | NA | 90.0° | 109.0° |
| C2A | C1A | CHA | 90.0° | 125.5° |
| CBA | CAA | H7 | 90.0° | 109.5° |
| CBA | CAA | H8 | 90.0° | 109.5° |
| CAA | CBA | H9 | 90.0° | 109.5° |
| CAA | CBA | H10 | 90.0° | 109.5° |
| NA | C1A | CHA | 90.0° | 125.5° |
| C1A | NA | H3 | 90.0° | 125.7° |
| C1A | CHA | C4D | 90.0° | 109.5° |
| C1A | CHA | H1 | 90.0° | 109.4° |
| C1A | CHA | H2 | 90.0° | 109.5° |
| CHA | C4D | ND | 90.0° | 125.9° |
| CHA | C4D | C3D | 90.0° | 125.9° |
| C4D | CHA | H1 | 90.0° | 109.5° |
| C4D | CHA | H2 | 90.0° | 109.5° |
| ND | C4D | C3D | 90.0° | 108.2° |
| C4D | ND | C1D | 90.0° | 108.8° |
| C4D | ND | H34 | 90.0° | 125.7° |
| C4D | C3D | CAD | 90.0° | 126.3° |
| C4D | C3D | C2D | 90.0° | 107.4° |
| ND | C1D | CHD | 90.0° | 125.9° |
| ND | C1D | C2D | 90.0° | 108.2° |
| C1D | ND | H34 | 90.0° | 125.6° |
| CHD | C1D | C2D | 90.0° | 125.9° |
| C1D | CHD | C4C | 90.0° | 109.5° |
| C1D | CHD | H32 | 90.0° | 109.4° |
| C1D | CHD | H33 | 90.0° | 109.4° |
| C1D | C2D | C3D | 90.0° | 107.4° |
| C1D | C2D | CMD | 90.0° | 126.3° |
| CAD | C3D | C2D | 90.0° | 126.3° |
| C3D | CAD | CBD | 90.0° | 109.5° |
| C3D | CAD | H38 | 90.0° | 109.5° |
| C3D | CAD | H39 | 90.0° | 109.5° |
| C3D | C2D | CMD | 90.0° | 126.3° |
| CHD | C4C | C3C | 90.0° | 125.0° |
| CHD | C4C | NC | 90.0° | 125.1° |
| C4C | CHD | H32 | 90.0° | 109.5° |
| C4C | CHD | H33 | 90.0° | 109.5° |
| CAD | CBD | CGD | 90.0° | 109.5° |
| CBD | CAD | H38 | 90.0° | 109.4° |
| CBD | CAD | H39 | 90.0° | 109.4° |
| CAD | CBD | H40 | 90.0° | 109.4° |
| CAD | CBD | H41 | 90.0° | 109.5° |
| O2D | CGD | CBD | 90.0° | 120.0° |
| O2D | CGD | O1D | 90.0° | 120.0° |
| C2D | CMD | H35 | 90.0° | 109.5° |
| C2D | CMD | H36 | 90.0° | 109.6° |
| C2D | CMD | H37 | 90.0° | 109.5° |
| CBC | CAC | C3C | 90.0° | 109.5° |
| CBC | CAC | H27 | 90.0° | 109.5° |
| CBC | CAC | H28 | 90.0° | 109.5° |
| CAC | CBC | H29 | 90.0° | 109.4° |
| CAC | CBC | H30 | 90.0° | 109.5° |
| CAC | CBC | H31 | 90.0° | 109.5° |
| CBD | CGD | O1D | 90.0° | 120.0° |
| CGD | CBD | H40 | 90.0° | 109.5° |
| CGD | CBD | H41 | 90.0° | 109.5° |
| CAC | C3C | C4C | 90.0° | 110.8° |
| CAC | C3C | C2C | 90.0° | 110.7° |
| CAC | C3C | H23 | 90.0° | 110.7° |
| C3C | CAC | H27 | 90.0° | 109.5° |
| C3C | CAC | H28 | 90.0° | 109.4° |
| CGD | O1D | H42 | 90.0° | 117.0° |
| C3C | C4C | NC | 90.0° | 109.9° |
| C4C | C3C | C2C | 90.0° | 103.2° |
| C4C | C3C | H23 | 90.0° | 110.7° |
| C4C | NC | C1C | 90.0° | 115.6° |
| C3C | C2C | CMC | 90.0° | 110.8° |
| C3C | C2C | C1C | 90.0° | 102.7° |
| C3C | C2C | H22 | 90.0° | 110.9° |
| C2C | C3C | H23 | 90.0° | 110.6° |
| NC | C1C | C2C | 90.0° | 108.7° |
| NC | C1C | OC | 90.0° | 125.7° |
| CMC | C2C | C1C | 90.0° | 110.8° |
| CMC | C2C | H22 | 90.0° | 110.6° |
| C2C | CMC | H24 | 90.0° | 109.5° |
| C2C | CMC | H25 | 90.0° | 109.5° |
| C2C | CMC | H26 | 90.0° | 109.4° |
| C2C | C1C | OC | 90.0° | 125.7° |
| C1C | C2C | H22 | 90.0° | 110.8° |
| H1 | CHA | H2 | 90.0° | 109.5° |
| H4 | CMA | H5 | 90.0° | 109.5° |
| H4 | CMA | H6 | 90.0° | 109.5° |
| H5 | CMA | H6 | 90.0° | 109.5° |
| H7 | CAA | H8 | 90.0° | 109.5° |
| H9 | CBA | H10 | 90.0° | 109.4° |
| H14 | CMB | H15 | 90.0° | 109.4° |
| H14 | CMB | H16 | 90.0° | 109.5° |
| H15 | CMB | H16 | 90.0° | 109.4° |
| H17 | CAB | H18 | 90.0° | 109.5° |
| H19 | CBB | H20 | 90.0° | 109.5° |
| H19 | CBB | H21 | 90.0° | 109.5° |
| H20 | CBB | H21 | 90.0° | 109.5° |
| H24 | CMC | H25 | 90.0° | 109.5° |
| H24 | CMC | H26 | 90.0° | 109.4° |
| H25 | CMC | H26 | 90.0° | 109.5° |
| H27 | CAC | H28 | 90.0° | 109.5° |
| H29 | CBC | H30 | 90.0° | 109.5° |
| H29 | CBC | H31 | 90.0° | 109.5° |
| H30 | CBC | H31 | 90.0° | 109.5° |
| H32 | CHD | H33 | 90.0° | 109.5° |
| H35 | CMD | H36 | 90.0° | 109.4° |
| H35 | CMD | H37 | 90.0° | 109.4° |
| H36 | CMD | H37 | 90.0° | 109.5° |
| H38 | CAD | H39 | 90.0° | 109.5° |
| H40 | CBD | H41 | 90.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OB | C4B | C3B | CAB | 90.0° | 0.1° |
| OB | C4B | C3B | NB | 90.0° | 179.7° |
| OB | C4B | C3B | C2B | 90.0° | 180.0° |
| OB | C4B | NB | C1B | 90.0° | 180.0° |
| OB | C4B | NB | H13 | 90.0° | 0.2° |
| CBB | CAB | C3B | H17 | 90.0° | 120.0° |
| CBB | CAB | C3B | H18 | 90.0° | 119.9° |
| CBB | CAB | C3B | C4B | 90.0° | 84.8° |
| CBB | CAB | C3B | C2B | 90.0° | 95.1° |
| CBB | CAB | H17 | H18 | 90.0° | 120.0° |
| CAB | CBB | H19 | H20 | 90.0° | 120.0° |
| CAB | CBB | H19 | H21 | 90.0° | 120.0° |
| CAB | CBB | H20 | H21 | 90.0° | 120.0° |
| CAB | C3B | C4B | C2B | 90.0° | 179.9° |
| CAB | C3B | C4B | NB | 90.0° | 179.8° |
| CAB | C3B | C2B | C1B | 90.0° | 180.0° |
| CAB | C3B | C2B | CMB | 90.0° | 0.1° |
| C3B | CAB | H17 | H18 | 90.0° | 120.0° |
| C3B | CAB | CBB | H19 | 90.0° | 60.0° |
| C3B | CAB | CBB | H20 | 90.0° | 180.0° |
| C3B | CAB | CBB | H21 | 90.0° | 60.0° |
| C3B | C4B | NB | C1B | 90.0° | 0.3° |
| C4B | C3B | C2B | C1B | 90.0° | 0.1° |
| C4B | C3B | C2B | CMB | 90.0° | 179.8° |
| C3B | C4B | NB | H13 | 90.0° | 179.9° |
| C4B | C3B | CAB | H17 | 90.0° | 35.2° |
| C4B | C3B | CAB | H18 | 90.0° | 155.3° |
| NB | C4B | C3B | C2B | 90.0° | 0.3° |
| C4B | NB | C1B | H13 | 90.0° | 179.7° |
| C4B | NB | C1B | C2B | 90.0° | 0.3° |
| C4B | NB | C1B | CHB | 90.0° | 179.8° |
| C3B | C2B | C1B | NB | 90.0° | 0.1° |
| C3B | C2B | C1B | CMB | 90.0° | 179.9° |
| C3B | C2B | C1B | CHB | 90.0° | 180.0° |
| C3B | C2B | CMB | H14 | 90.0° | 179.9° |
| C3B | C2B | CMB | H15 | 90.0° | 59.9° |
| C3B | C2B | CMB | H16 | 90.0° | 60.1° |
| C2B | C3B | CAB | H17 | 90.0° | 144.9° |
| C2B | C3B | CAB | H18 | 90.0° | 24.9° |
| NB | C1B | C2B | CHB | 90.0° | 179.9° |
| NB | C1B | C2B | CMB | 90.0° | 180.0° |
| NB | C1B | CHB | C4A | 90.0° | 7.8° |
| NB | C1B | CHB | H12 | 90.0° | 172.2° |
| C2B | C1B | CHB | C4A | 90.0° | 172.1° |
| C2B | C1B | CHB | H12 | 90.0° | 7.9° |
| C2B | C1B | NB | H13 | 90.0° | 180.0° |
| C1B | C2B | CMB | H14 | 90.0° | 0.0° |
| C1B | C2B | CMB | H15 | 90.0° | 120.0° |
| C1B | C2B | CMB | H16 | 90.0° | 120.0° |
| CMB | C2B | C1B | CHB | 90.0° | 0.1° |
| C2B | CMB | H14 | H15 | 90.0° | 120.0° |
| C2B | CMB | H14 | H16 | 90.0° | 120.0° |
| C2B | CMB | H15 | H16 | 90.0° | 120.0° |
| C1B | CHB | C4A | H12 | 90.0° | 180.0° |
| C1B | CHB | C4A | C3A | 90.0° | 163.6° |
| C1B | CHB | C4A | NA | 90.0° | 16.9° |
| CHB | C1B | NB | H13 | 90.0° | 0.1° |
| CMA | C3A | C4A | CHB | 90.0° | 0.4° |
| CMA | C3A | C4A | C2A | 90.0° | 179.6° |
| CMA | C3A | C4A | NA | 90.0° | 180.0° |
| CMA | C3A | C2A | CAA | 90.0° | 0.1° |
| CMA | C3A | C2A | C1A | 90.0° | 179.9° |
| C3A | CMA | H4 | H5 | 90.0° | 120.0° |
| C3A | CMA | H4 | H6 | 90.0° | 120.0° |
| C3A | CMA | H5 | H6 | 90.0° | 120.0° |
| O1A | CGA | O2A | CBA | 90.0° | 179.9° |
| O1A | CGA | CBA | CAA | 90.0° | 0.0° |
| O1A | CGA | CBA | H9 | 90.0° | 120.1° |
| O1A | CGA | CBA | H10 | 90.0° | 120.0° |
| O1A | CGA | O2A | H11 | 90.0° | 0.1° |
| CHB | C4A | C3A | NA | 90.0° | 179.6° |
| CHB | C4A | C3A | C2A | 90.0° | 180.0° |
| CHB | C4A | NA | C1A | 90.0° | 180.0° |
| CHB | C4A | NA | H3 | 90.0° | 0.2° |
| O2A | CGA | CBA | CAA | 90.0° | 180.0° |
| O2A | CGA | CBA | H9 | 90.0° | 60.0° |
| O2A | CGA | CBA | H10 | 90.0° | 60.0° |
| C4A | C3A | C2A | CAA | 90.0° | 179.7° |
| C4A | C3A | C2A | C1A | 90.0° | 0.3° |
| C3A | C4A | NA | C1A | 90.0° | 0.4° |
| C3A | C4A | NA | H3 | 90.0° | 179.8° |
| C4A | C3A | CMA | H4 | 90.0° | 90.0° |
| C4A | C3A | CMA | H5 | 90.0° | 150.0° |
| C4A | C3A | CMA | H6 | 90.0° | 30.0° |
| C3A | C4A | CHB | H12 | 90.0° | 16.4° |
| C2A | C3A | C4A | NA | 90.0° | 0.4° |
| C3A | C2A | CAA | C1A | 90.0° | 180.0° |
| C3A | C2A | CAA | CBA | 90.0° | 90.0° |
| C3A | C2A | C1A | NA | 90.0° | 0.0° |
| C3A | C2A | C1A | CHA | 90.0° | 180.0° |
| C2A | C3A | CMA | H4 | 90.0° | 90.5° |
| C2A | C3A | CMA | H5 | 90.0° | 29.5° |
| C2A | C3A | CMA | H6 | 90.0° | 149.5° |
| C3A | C2A | CAA | H7 | 90.0° | 30.0° |
| C3A | C2A | CAA | H8 | 90.0° | 150.0° |
| CGA | CBA | CAA | C2A | 90.0° | 180.0° |
| CGA | CBA | CAA | H9 | 90.0° | 120.0° |
| CGA | CBA | CAA | H10 | 90.0° | 120.0° |
| CGA | CBA | CAA | H7 | 90.0° | 60.0° |
| CGA | CBA | CAA | H8 | 90.0° | 60.0° |
| CGA | CBA | H9 | H10 | 90.0° | 120.0° |
| CBA | CGA | O2A | H11 | 90.0° | 180.0° |
| C4A | NA | C1A | C2A | 90.0° | 0.2° |
| C4A | NA | C1A | H3 | 90.0° | 179.8° |
| C4A | NA | C1A | CHA | 90.0° | 179.8° |
| NA | C4A | CHB | H12 | 90.0° | 163.1° |
| C2A | CAA | CBA | H7 | 90.0° | 120.0° |
| C2A | CAA | CBA | H8 | 90.0° | 120.0° |
| CAA | C2A | C1A | NA | 90.0° | 180.0° |
| CAA | C2A | C1A | CHA | 90.0° | 0.1° |
| C2A | CAA | H7 | H8 | 90.0° | 120.0° |
| C2A | CAA | CBA | H9 | 90.0° | 60.0° |
| C2A | CAA | CBA | H10 | 90.0° | 60.0° |
| C1A | C2A | CAA | CBA | 90.0° | 90.0° |
| C2A | C1A | NA | CHA | 90.0° | 180.0° |
| C2A | C1A | CHA | C4D | 90.0° | 85.0° |
| C2A | C1A | CHA | H1 | 90.0° | 155.0° |
| C2A | C1A | CHA | H2 | 90.0° | 35.0° |
| C2A | C1A | NA | H3 | 90.0° | 180.0° |
| C1A | C2A | CAA | H7 | 90.0° | 150.0° |
| C1A | C2A | CAA | H8 | 90.0° | 30.0° |
| CBA | CAA | H7 | H8 | 90.0° | 120.0° |
| CAA | CBA | H9 | H10 | 90.0° | 120.0° |
| NA | C1A | CHA | C4D | 90.0° | 95.0° |
| NA | C1A | CHA | H1 | 90.0° | 25.0° |
| NA | C1A | CHA | H2 | 90.0° | 145.0° |
| C1A | CHA | C4D | H1 | 90.0° | 120.0° |
| C1A | CHA | C4D | H2 | 90.0° | 120.0° |
| C1A | CHA | C4D | ND | 90.0° | 94.9° |
| C1A | CHA | C4D | C3D | 90.0° | 85.5° |
| C1A | CHA | H1 | H2 | 90.0° | 120.0° |
| CHA | C1A | NA | H3 | 90.0° | 0.0° |
| CHA | C4D | ND | C3D | 90.0° | 179.6° |
| CHA | C4D | ND | C1D | 90.0° | 180.0° |
| CHA | C4D | C3D | CAD | 90.0° | 0.3° |
| CHA | C4D | C3D | C2D | 90.0° | 180.0° |
| C4D | CHA | H1 | H2 | 90.0° | 120.0° |
| CHA | C4D | ND | H34 | 90.0° | 0.2° |
| C4D | ND | C1D | H34 | 90.0° | 179.8° |
| C4D | ND | C1D | CHD | 90.0° | 179.8° |
| C4D | ND | C1D | C2D | 90.0° | 0.2° |
| ND | C4D | C3D | CAD | 90.0° | 179.9° |
| ND | C4D | C3D | C2D | 90.0° | 0.4° |
| ND | C4D | CHA | H1 | 90.0° | 145.1° |
| ND | C4D | CHA | H2 | 90.0° | 25.0° |
| C3D | C4D | ND | C1D | 90.0° | 0.4° |
| C4D | C3D | C2D | C1D | 90.0° | 0.3° |
| C4D | C3D | CAD | C2D | 90.0° | 179.6° |
| C4D | C3D | CAD | CBD | 90.0° | 89.6° |
| C4D | C3D | C2D | CMD | 90.0° | 179.8° |
| C3D | C4D | CHA | H1 | 90.0° | 34.4° |
| C3D | C4D | CHA | H2 | 90.0° | 154.5° |
| C3D | C4D | ND | H34 | 90.0° | 179.8° |
| C4D | C3D | CAD | H38 | 90.0° | 30.3° |
| C4D | C3D | CAD | H39 | 90.0° | 150.4° |
| ND | C1D | CHD | C2D | 90.0° | 180.0° |
| ND | C1D | C2D | C3D | 90.0° | 0.1° |
| ND | C1D | CHD | C4C | 90.0° | 95.0° |
| ND | C1D | C2D | CMD | 90.0° | 180.0° |
| ND | C1D | CHD | H32 | 90.0° | 145.0° |
| ND | C1D | CHD | H33 | 90.0° | 25.0° |
| CHD | C1D | C2D | C3D | 90.0° | 180.0° |
| C1D | CHD | C4C | H32 | 90.0° | 120.0° |
| C1D | CHD | C4C | H33 | 90.0° | 120.0° |
| CHD | C1D | C2D | CMD | 90.0° | 0.0° |
| C1D | CHD | C4C | C3C | 90.0° | 176.5° |
| C1D | CHD | C4C | NC | 90.0° | 3.6° |
| C1D | CHD | H32 | H33 | 90.0° | 120.0° |
| CHD | C1D | ND | H34 | 90.0° | 0.1° |
| C1D | C2D | C3D | CAD | 90.0° | 180.0° |
| C1D | C2D | C3D | CMD | 90.0° | 179.9° |
| C2D | C1D | CHD | C4C | 90.0° | 85.0° |
| C2D | C1D | CHD | H32 | 90.0° | 35.0° |
| C2D | C1D | CHD | H33 | 90.0° | 154.9° |
| C2D | C1D | ND | H34 | 90.0° | 180.0° |
| C1D | C2D | CMD | H35 | 90.0° | 90.0° |
| C1D | C2D | CMD | H36 | 90.0° | 150.0° |
| C1D | C2D | CMD | H37 | 90.0° | 29.9° |
| C3D | CAD | CBD | H38 | 90.0° | 120.0° |
| C3D | CAD | CBD | H39 | 90.0° | 120.0° |
| CAD | C3D | C2D | CMD | 90.0° | 0.1° |
| C3D | CAD | CBD | CGD | 90.0° | NaN° |
| C3D | CAD | H38 | H39 | 90.0° | 120.0° |
| C3D | CAD | CBD | H40 | 90.0° | 60.0° |
| C3D | CAD | CBD | H41 | 90.0° | 60.0° |
| C2D | C3D | CAD | CBD | 90.0° | 90.0° |
| C3D | C2D | CMD | H35 | 90.0° | 90.0° |
| C3D | C2D | CMD | H36 | 90.0° | 30.0° |
| C3D | C2D | CMD | H37 | 90.0° | 150.0° |
| C2D | C3D | CAD | H38 | 90.0° | 150.0° |
| C2D | C3D | CAD | H39 | 90.0° | 30.0° |
| CHD | C4C | C3C | CAC | 90.0° | 61.5° |
| CHD | C4C | C3C | NC | 90.0° | 180.0° |
| CHD | C4C | C3C | C2C | 90.0° | 180.0° |
| CHD | C4C | NC | C1C | 90.0° | 180.0° |
| CHD | C4C | C3C | H23 | 90.0° | 61.6° |
| C4C | CHD | H32 | H33 | 90.0° | 120.1° |
| CAD | CBD | CGD | O2D | 90.0° | 0.0° |
| CAD | CBD | CGD | H40 | 90.0° | 119.9° |
| CAD | CBD | CGD | H41 | 90.0° | 120.0° |
| CAD | CBD | CGD | O1D | 90.0° | 179.9° |
| CBD | CAD | H38 | H39 | 90.0° | 120.0° |
| CAD | CBD | H40 | H41 | 90.0° | 120.0° |
| O2D | CGD | CBD | O1D | 90.0° | 179.9° |
| O2D | CGD | CBD | H40 | 90.0° | 119.9° |
| O2D | CGD | CBD | H41 | 90.0° | 120.1° |
| O2D | CGD | O1D | H42 | 90.0° | 0.1° |
| C2D | CMD | H35 | H36 | 90.0° | 120.1° |
| C2D | CMD | H35 | H37 | 90.0° | 120.0° |
| C2D | CMD | H36 | H37 | 90.0° | 120.0° |
| CBC | CAC | C3C | H27 | 90.0° | 120.0° |
| CBC | CAC | C3C | H28 | 90.0° | 120.0° |
| CBC | CAC | C3C | C4C | 90.0° | 177.5° |
| CBC | CAC | C3C | C2C | 90.0° | 63.7° |
| CBC | CAC | C3C | H23 | 90.0° | 59.3° |
| CBC | CAC | H27 | H28 | 90.0° | 120.1° |
| CAC | CBC | H29 | H30 | 90.0° | 120.0° |
| CAC | CBC | H29 | H31 | 90.0° | 120.0° |
| CAC | CBC | H30 | H31 | 90.0° | 120.0° |
| CGD | CBD | CAD | H38 | 90.0° | 60.0° |
| CGD | CBD | CAD | H39 | 90.0° | 60.0° |
| CGD | CBD | H40 | H41 | 90.0° | 120.0° |
| CBD | CGD | O1D | H42 | 90.0° | 180.0° |
| CAC | C3C | C4C | C2C | 90.0° | 118.5° |
| CAC | C3C | C4C | H23 | 90.0° | 123.2° |
| CAC | C3C | C4C | NC | 90.0° | 118.5° |
| CAC | C3C | C2C | H23 | 90.0° | 123.0° |
| CAC | C3C | C2C | CMC | 90.0° | 123.1° |
| CAC | C3C | C2C | C1C | 90.0° | 118.6° |
| CAC | C3C | C2C | H22 | 90.0° | 0.2° |
| C3C | CAC | H27 | H28 | 90.0° | 120.0° |
| C3C | CAC | CBC | H29 | 90.0° | 174.3° |
| C3C | CAC | CBC | H30 | 90.0° | 54.3° |
| C3C | CAC | CBC | H31 | 90.0° | 65.8° |
| O1D | CGD | CBD | H40 | 90.0° | 60.0° |
| O1D | CGD | CBD | H41 | 90.0° | 60.0° |
| C4C | C3C | C2C | H23 | 90.0° | 118.4° |
| C3C | C4C | NC | C1C | 90.0° | 0.0° |
| C4C | C3C | C2C | CMC | 90.0° | 118.3° |
| C4C | C3C | C2C | C1C | 90.0° | 0.0° |
| C4C | C3C | C2C | H22 | 90.0° | 118.4° |
| C4C | C3C | CAC | H27 | 90.0° | 57.5° |
| C4C | C3C | CAC | H28 | 90.0° | 62.5° |
| C3C | C4C | CHD | H32 | 90.0° | 63.6° |
| C3C | C4C | CHD | H33 | 90.0° | 56.5° |
| NC | C4C | C3C | C2C | 90.0° | 0.0° |
| C4C | NC | C1C | C2C | 90.0° | 0.0° |
| C4C | NC | C1C | OC | 90.0° | 180.0° |
| NC | C4C | C3C | H23 | 90.0° | 118.3° |
| NC | C4C | CHD | H32 | 90.0° | 116.4° |
| NC | C4C | CHD | H33 | 90.0° | 123.6° |
| C3C | C2C | C1C | NC | 90.0° | 0.0° |
| C3C | C2C | CMC | C1C | 90.0° | 113.3° |
| C3C | C2C | CMC | H22 | 90.0° | 123.4° |
| C3C | C2C | C1C | H22 | 90.0° | 118.5° |
| C3C | C2C | C1C | OC | 90.0° | 180.0° |
| C3C | C2C | CMC | H24 | 90.0° | 174.7° |
| C3C | C2C | CMC | H25 | 90.0° | 65.2° |
| C3C | C2C | CMC | H26 | 90.0° | 54.8° |
| C2C | C3C | CAC | H27 | 90.0° | 56.3° |
| C2C | C3C | CAC | H28 | 90.0° | 176.3° |
| NC | C1C | C2C | CMC | 90.0° | 118.4° |
| NC | C1C | C2C | OC | 90.0° | 180.0° |
| NC | C1C | C2C | H22 | 90.0° | 118.5° |
| CMC | C2C | C1C | H22 | 90.0° | 123.1° |
| CMC | C2C | C1C | OC | 90.0° | 61.6° |
| CMC | C2C | C3C | H23 | 90.0° | 0.1° |
| C2C | CMC | H24 | H25 | 90.0° | 120.1° |
| C2C | CMC | H24 | H26 | 90.0° | 119.9° |
| C2C | CMC | H25 | H26 | 90.0° | 120.0° |
| C1C | C2C | C3C | H23 | 90.0° | 118.4° |
| C1C | C2C | CMC | H24 | 90.0° | 61.4° |
| C1C | C2C | CMC | H25 | 90.0° | 178.6° |
| C1C | C2C | CMC | H26 | 90.0° | 58.5° |
| OC | C1C | C2C | H22 | 90.0° | 61.5° |
| H4 | CMA | H5 | H6 | 90.0° | 120.0° |
| H7 | CAA | CBA | H9 | 90.0° | 180.0° |
| H7 | CAA | CBA | H10 | 90.0° | 60.0° |
| H8 | CAA | CBA | H9 | 90.0° | 60.0° |
| H8 | CAA | CBA | H10 | 90.0° | NaN° |
| H14 | CMB | H15 | H16 | 90.0° | 120.0° |
| H17 | CAB | CBB | H19 | 90.0° | 60.0° |
| H17 | CAB | CBB | H20 | 90.0° | 60.0° |
| H17 | CAB | CBB | H21 | 90.0° | 180.0° |
| H18 | CAB | CBB | H19 | 90.0° | 180.0° |
| H18 | CAB | CBB | H20 | 90.0° | 60.0° |
| H18 | CAB | CBB | H21 | 90.0° | 60.0° |
| H19 | CBB | H20 | H21 | 90.0° | 120.0° |
| H22 | C2C | C3C | H23 | 90.0° | 123.2° |
| H22 | C2C | CMC | H24 | 90.0° | 61.8° |
| H22 | C2C | CMC | H25 | 90.0° | 58.2° |
| H22 | C2C | CMC | H26 | 90.0° | 178.2° |
| H23 | C3C | CAC | H27 | 90.0° | 179.3° |
| H23 | C3C | CAC | H28 | 90.0° | 60.7° |
| H24 | CMC | H25 | H26 | 90.0° | 119.9° |
| H27 | CAC | CBC | H29 | 90.0° | 65.8° |
| H27 | CAC | CBC | H30 | 90.0° | 174.3° |
| H27 | CAC | CBC | H31 | 90.0° | 54.2° |
| H28 | CAC | CBC | H29 | 90.0° | 54.3° |
| H28 | CAC | CBC | H30 | 90.0° | 65.7° |
| H28 | CAC | CBC | H31 | 90.0° | 174.3° |
| H29 | CBC | H30 | H31 | 90.0° | 120.0° |
| H35 | CMD | H36 | H37 | 90.0° | 119.9° |
| H38 | CAD | CBD | H40 | 90.0° | NaN° |
| H38 | CAD | CBD | H41 | 90.0° | 60.0° |
| H39 | CAD | CBD | H40 | 90.0° | 60.0° |
| H39 | CAD | CBD | H41 | 90.0° | 180.0° |
