Y07
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAI | PAG | doub | 1.48Å | 1.57Å | |
| CL1 | CAT | sing | 1.74Å | 1.72Å | |
| OAK | CAB | sing | 1.36Å | 1.38Å | |
| OAK | CAL | sing | 1.43Å | 1.45Å | |
| CAA | CAB | doub | 1.39Å | 1.41Å | Aromatic |
| CAA | CAF | sing | 1.38Å | 1.41Å | Aromatic |
| CAB | CAC | sing | 1.39Å | 1.39Å | Aromatic |
| CAF | CAE | doub | 1.38Å | 1.41Å | Aromatic |
| CAC | PAG | sing | 1.81Å | 1.83Å | |
| CAC | CAD | doub | 1.38Å | 1.40Å | Aromatic |
| PAG | OAJ | sing | 1.61Å | 1.61Å | |
| PAG | OAH | sing | 1.61Å | 1.50Å | |
| CAE | CAD | sing | 1.38Å | 1.40Å | Aromatic |
| CAL | CAM | sing | 1.51Å | 1.55Å | |
| CAM | OAO | doub | 1.21Å | 1.23Å | |
| CAM | NAN | sing | 1.35Å | 1.34Å | |
| CAT | CAP | doub | 1.39Å | 1.39Å | Aromatic |
| CAT | CAS | sing | 1.38Å | 1.39Å | Aromatic |
| NAN | CAP | sing | 1.40Å | 1.35Å | |
| CAP | CAU | sing | 1.39Å | 1.39Å | Aromatic |
| CAS | CAR | doub | 1.38Å | 1.39Å | Aromatic |
| CAU | CAQ | doub | 1.38Å | 1.39Å | Aromatic |
| CAR | CAQ | sing | 1.38Å | 1.39Å | Aromatic |
| CAQ | CAW | sing | 1.51Å | 1.54Å | |
| CAW | FAZ | sing | 1.40Å | 1.32Å | |
| CAW | FAX | sing | 1.40Å | 1.33Å | |
| CAW | FAY | sing | 1.40Å | 1.33Å | |
| OAJ | H1 | sing | 0.97Å | 0.95Å | |
| OAH | H2 | sing | 0.97Å | 0.95Å | |
| CAD | H3 | sing | 1.08Å | 1.08Å | |
| CAE | H4 | sing | 1.08Å | 1.08Å | |
| CAF | H5 | sing | 1.08Å | 1.08Å | |
| CAA | H6 | sing | 1.08Å | 1.08Å | |
| CAL | H7 | sing | 1.09Å | 1.10Å | |
| CAL | H8 | sing | 1.09Å | 1.10Å | |
| NAN | H9 | sing | 0.97Å | 1.00Å | |
| CAU | H10 | sing | 1.08Å | 1.08Å | |
| CAR | H11 | sing | 1.08Å | 1.08Å | |
| CAS | H12 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAI | PAG | CAC | 106.4° | 109.5° |
| OAI | PAG | OAJ | 110.1° | 109.5° |
| OAI | PAG | OAH | 113.3° | 109.4° |
| CL1 | CAT | CAP | 121.0° | 120.0° |
| CL1 | CAT | CAS | 118.7° | 120.1° |
| CAB | OAK | CAL | 120.3° | 117.0° |
| OAK | CAB | CAA | 122.4° | 120.1° |
| OAK | CAB | CAC | 117.5° | 120.0° |
| OAK | CAL | CAM | 112.9° | 109.5° |
| OAK | CAL | H7 | 108.6° | 109.4° |
| OAK | CAL | H8 | 108.6° | 109.5° |
| CAB | CAA | CAF | 118.5° | 119.9° |
| CAA | CAB | CAC | 120.1° | 119.9° |
| CAB | CAA | H6 | 120.7° | 120.0° |
| CAA | CAF | CAE | 120.5° | 120.0° |
| CAA | CAF | H5 | 119.7° | 119.9° |
| CAF | CAA | H6 | 120.7° | 120.1° |
| CAB | CAC | PAG | 118.7° | 120.0° |
| CAB | CAC | CAD | 122.1° | 119.9° |
| CAF | CAE | CAD | 120.5° | 120.1° |
| CAF | CAE | H4 | 119.7° | 119.9° |
| CAE | CAF | H5 | 119.7° | 120.0° |
| PAG | CAC | CAD | 119.3° | 120.0° |
| CAC | PAG | OAJ | 106.1° | 109.5° |
| CAC | PAG | OAH | 112.8° | 109.5° |
| CAC | CAD | CAE | 118.3° | 120.1° |
| CAC | CAD | H3 | 120.9° | 120.0° |
| OAJ | PAG | OAH | 107.8° | 109.5° |
| PAG | OAJ | H1 | 109.5° | 114.0° |
| PAG | OAH | H2 | 109.5° | 113.9° |
| CAE | CAD | H3 | 120.9° | 120.0° |
| CAD | CAE | H4 | 119.7° | 119.9° |
| CAL | CAM | OAO | 117.2° | 120.0° |
| CAL | CAM | NAN | 120.7° | 120.0° |
| CAM | CAL | H7 | 108.6° | 109.5° |
| CAM | CAL | H8 | 108.6° | 109.5° |
| OAO | CAM | NAN | 122.1° | 120.0° |
| CAM | NAN | CAP | 121.9° | 120.0° |
| CAM | NAN | H9 | 119.0° | 120.0° |
| CAP | CAT | CAS | 120.4° | 119.9° |
| CAT | CAP | NAN | 124.1° | 120.0° |
| CAT | CAP | CAU | 118.4° | 119.9° |
| CAT | CAS | CAR | 120.4° | 120.1° |
| CAT | CAS | H12 | 119.8° | 119.9° |
| NAN | CAP | CAU | 117.5° | 120.1° |
| CAP | NAN | H9 | 119.0° | 120.1° |
| CAP | CAU | CAQ | 121.7° | 119.9° |
| CAP | CAU | H10 | 119.2° | 120.1° |
| CAS | CAR | CAQ | 119.8° | 120.2° |
| CAS | CAR | H11 | 120.1° | 119.9° |
| CAR | CAS | H12 | 119.8° | 120.0° |
| CAU | CAQ | CAR | 119.3° | 120.1° |
| CAU | CAQ | CAW | 119.4° | 120.0° |
| CAQ | CAU | H10 | 119.1° | 120.0° |
| CAR | CAQ | CAW | 121.3° | 119.9° |
| CAQ | CAR | H11 | 120.1° | 119.9° |
| CAQ | CAW | FAZ | 108.4° | 109.5° |
| CAQ | CAW | FAX | 109.4° | 109.5° |
| CAQ | CAW | FAY | 111.9° | 109.5° |
| FAZ | CAW | FAX | 108.7° | 109.5° |
| FAZ | CAW | FAY | 108.3° | 109.4° |
| FAX | CAW | FAY | 110.1° | 109.5° |
| H7 | CAL | H8 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAI | PAG | CAC | CAB | 68.6° | 90.3° |
| OAI | PAG | CAC | OAJ | 117.3° | 120.0° |
| OAI | PAG | CAC | OAH | 124.8° | 120.0° |
| OAI | PAG | CAC | CAD | 110.7° | 90.1° |
| OAI | PAG | OAJ | OAH | 124.1° | 120.0° |
| OAI | PAG | OAJ | H1 | 0.0° | 60.0° |
| OAI | PAG | OAH | H2 | 0.0° | 180.0° |
| CL1 | CAT | CAP | CAS | 179.9° | 179.7° |
| CL1 | CAT | CAP | NAN | 0.5° | 0.1° |
| CL1 | CAT | CAP | CAU | 179.5° | 179.8° |
| CL1 | CAT | CAS | CAR | 179.6° | 179.8° |
| CL1 | CAT | CAS | H12 | 0.3° | 0.0° |
| OAK | CAB | CAA | CAC | 179.1° | 179.3° |
| OAK | CAB | CAA | CAF | 179.3° | 180.0° |
| OAK | CAB | CAC | PAG | 0.6° | 0.4° |
| OAK | CAB | CAC | CAD | 178.7° | 180.0° |
| CAB | OAK | CAL | CAM | 137.8° | 180.0° |
| OAK | CAB | CAA | H6 | 0.7° | 0.7° |
| CAB | OAK | CAL | H7 | 101.7° | 60.0° |
| CAB | OAK | CAL | H8 | 17.3° | 59.9° |
| CAL | OAK | CAB | CAA | 42.9° | 0.1° |
| CAL | OAK | CAB | CAC | 138.0° | 179.4° |
| OAK | CAL | CAM | H7 | 120.5° | 119.9° |
| OAK | CAL | CAM | H8 | 120.5° | 120.0° |
| OAK | CAL | CAM | OAO | 161.5° | 0.0° |
| OAK | CAL | CAM | NAN | 18.1° | 179.9° |
| OAK | CAL | H7 | H8 | 118.4° | 120.0° |
| CAB | CAA | CAF | H6 | 180.0° | 179.3° |
| CAB | CAA | CAF | CAE | 0.7° | 0.4° |
| CAA | CAB | CAC | PAG | 179.7° | 179.7° |
| CAA | CAB | CAC | CAD | 0.5° | 0.7° |
| CAB | CAA | CAF | H5 | 179.3° | 179.7° |
| CAF | CAA | CAB | CAC | 0.3° | 0.7° |
| CAA | CAF | CAE | H5 | 180.0° | 179.9° |
| CAA | CAF | CAE | CAD | 0.4° | 0.1° |
| CAA | CAF | CAE | H4 | 179.6° | 179.9° |
| CAB | CAC | PAG | CAD | 179.3° | 179.6° |
| CAB | CAC | PAG | OAJ | 174.1° | 149.7° |
| CAB | CAC | PAG | OAH | 56.2° | 29.7° |
| CAB | CAC | CAD | CAE | 0.7° | 0.4° |
| CAB | CAC | CAD | H3 | 179.3° | 179.7° |
| CAC | CAB | CAA | H6 | 179.7° | 180.0° |
| CAF | CAE | CAD | CAC | 0.3° | 0.1° |
| CAF | CAE | CAD | H4 | 180.0° | 180.0° |
| CAF | CAE | CAD | H3 | 179.7° | 180.0° |
| CAE | CAF | CAA | H6 | 179.3° | 179.7° |
| CAC | PAG | OAJ | OAH | 121.1° | 120.1° |
| PAG | CAC | CAD | CAE | 180.0° | 180.0° |
| CAC | PAG | OAJ | H1 | 114.8° | 180.0° |
| CAC | PAG | OAH | H2 | 121.0° | 60.0° |
| PAG | CAC | CAD | H3 | 0.0° | 0.1° |
| CAD | CAC | PAG | OAJ | 6.6° | 29.9° |
| CAD | CAC | PAG | OAH | 124.5° | 150.0° |
| CAC | CAD | CAE | H3 | 180.0° | 179.9° |
| CAC | CAD | CAE | H4 | 179.7° | 179.9° |
| OAJ | PAG | OAH | H2 | 122.1° | 60.1° |
| OAH | PAG | OAJ | H1 | 124.1° | 60.0° |
| CAD | CAE | CAF | H5 | 179.5° | 180.0° |
| CAL | CAM | OAO | NAN | 179.7° | 180.0° |
| CAL | CAM | NAN | CAP | 175.1° | 174.4° |
| CAM | CAL | H7 | H8 | 118.4° | 120.1° |
| CAL | CAM | NAN | H9 | 4.9° | 5.5° |
| OAO | CAM | NAN | CAP | 5.2° | 5.6° |
| OAO | CAM | CAL | H7 | 41.1° | 119.9° |
| OAO | CAM | CAL | H8 | 77.9° | 120.0° |
| OAO | CAM | NAN | H9 | 174.7° | 174.5° |
| CAM | NAN | CAP | CAT | 91.2° | 154.9° |
| CAM | NAN | CAP | H9 | 180.0° | 179.9° |
| CAM | NAN | CAP | CAU | 89.8° | 24.8° |
| NAN | CAM | CAL | H7 | 138.6° | 60.0° |
| NAN | CAM | CAL | H8 | 102.4° | 60.0° |
| CAT | CAP | NAN | CAU | 179.0° | 179.7° |
| CAP | CAT | CAS | CAR | 0.3° | 0.5° |
| CAT | CAP | CAU | CAQ | 0.6° | 0.3° |
| CAT | CAP | NAN | H9 | 88.8° | 25.2° |
| CAT | CAP | CAU | H10 | 179.5° | 179.8° |
| CAP | CAT | CAS | H12 | 179.7° | 179.7° |
| CAS | CAT | CAP | NAN | 179.6° | 179.8° |
| CAS | CAT | CAP | CAU | 0.6° | 0.5° |
| CAT | CAS | CAR | H12 | 180.0° | 179.8° |
| CAT | CAS | CAR | CAQ | 1.2° | 0.2° |
| CAT | CAS | CAR | H11 | 178.8° | 179.7° |
| NAN | CAP | CAU | CAQ | 179.6° | 180.0° |
| NAN | CAP | CAU | H10 | 0.4° | 0.1° |
| CAP | CAU | CAQ | H10 | 180.0° | 179.9° |
| CAP | CAU | CAQ | CAR | 0.3° | 0.0° |
| CAP | CAU | CAQ | CAW | 179.9° | 180.0° |
| CAU | CAP | NAN | H9 | 90.2° | 155.1° |
| CAS | CAR | CAQ | CAU | 1.2° | 0.0° |
| CAS | CAR | CAQ | H11 | 180.0° | 179.9° |
| CAS | CAR | CAQ | CAW | 179.2° | 179.9° |
| CAU | CAQ | CAR | CAW | 179.6° | 180.0° |
| CAU | CAQ | CAW | FAZ | 66.7° | 89.9° |
| CAU | CAQ | CAW | FAX | 51.7° | 150.0° |
| CAU | CAQ | CAW | FAY | 174.0° | 30.0° |
| CAU | CAQ | CAR | H11 | 178.8° | 179.9° |
| CAR | CAQ | CAW | FAZ | 113.8° | 90.0° |
| CAR | CAQ | CAW | FAX | 127.8° | 30.0° |
| CAR | CAQ | CAW | FAY | 5.5° | 150.1° |
| CAR | CAQ | CAU | H10 | 179.6° | 180.0° |
| CAQ | CAR | CAS | H12 | 178.8° | 180.0° |
| CAQ | CAW | FAZ | FAX | 118.9° | 120.1° |
| CAQ | CAW | FAZ | FAY | 121.6° | 120.0° |
| CAQ | CAW | FAX | FAY | 123.4° | 120.1° |
| CAW | CAQ | CAU | H10 | 0.1° | 0.1° |
| CAW | CAQ | CAR | H11 | 0.8° | 0.0° |
| FAZ | CAW | FAX | FAY | 118.4° | 119.9° |
| H3 | CAD | CAE | H4 | 0.3° | 0.0° |
| H4 | CAE | CAF | H5 | 0.5° | 0.0° |
| H5 | CAF | CAA | H6 | 0.7° | 0.4° |
| H11 | CAR | CAS | H12 | 1.2° | 0.1° |
