G0H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAY | CAX | doub | 1.39Å | 1.36Å | Aromatic |
| CAY | CAZ | sing | 1.37Å | 1.41Å | Aromatic |
| CAX | CAW | sing | 1.36Å | 1.35Å | Aromatic |
| CAZ | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| CAW | C4 | doub | 1.40Å | 1.38Å | Aromatic |
| C5 | C4 | sing | 1.42Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.42Å | 1.41Å | Aromatic |
| C4 | N3 | sing | 1.34Å | 1.32Å | Aromatic |
| NBB | C6 | sing | 1.38Å | 1.34Å | |
| NBB | CAC | sing | 1.40Å | 1.34Å | |
| C6 | N1 | doub | 1.32Å | 1.32Å | Aromatic |
| CAG | CAB | sing | 1.51Å | 1.42Å | |
| N3 | C2 | doub | 1.32Å | 1.32Å | Aromatic |
| CAC | CAB | doub | 1.39Å | 1.39Å | Aromatic |
| CAC | CAD | sing | 1.39Å | 1.39Å | Aromatic |
| CAB | CAA | sing | 1.38Å | 1.39Å | Aromatic |
| N1 | C2 | sing | 1.33Å | 1.32Å | Aromatic |
| CAD | CAE | doub | 1.39Å | 1.40Å | Aromatic |
| C2 | CBA | sing | 1.48Å | 1.39Å | |
| CAA | CAF | doub | 1.38Å | 1.40Å | Aromatic |
| CAE | CAF | sing | 1.40Å | 1.39Å | Aromatic |
| CAE | CAH | sing | 1.48Å | 1.43Å | |
| OAI | CAH | doub | 1.22Å | 1.21Å | |
| CBA | CBC | doub | 1.40Å | 1.36Å | Aromatic |
| CBA | CBG | sing | 1.39Å | 1.37Å | Aromatic |
| CAH | NAJ | sing | 1.35Å | 1.36Å | |
| FBK | CBH | sing | 1.40Å | 0.95Å | |
| CBC | CBD | sing | 1.38Å | 1.38Å | Aromatic |
| CBG | NBF | doub | 1.32Å | 1.39Å | Aromatic |
| CBH | FBJ | sing | 1.40Å | 1.15Å | |
| CBH | FBI | sing | 1.40Å | 1.13Å | |
| CBH | CAM | sing | 1.51Å | 1.46Å | |
| CAL | CAK | doub | 1.39Å | 1.41Å | Aromatic |
| CAL | CAM | sing | 1.38Å | 1.41Å | Aromatic |
| NAJ | CAK | sing | 1.40Å | 1.38Å | |
| CBD | CBE | doub | 1.38Å | 1.38Å | Aromatic |
| CAK | CAP | sing | 1.39Å | 1.40Å | Aromatic |
| CAM | CAN | doub | 1.38Å | 1.40Å | Aromatic |
| NBF | CBE | sing | 1.32Å | 1.40Å | Aromatic |
| CAP | CAO | doub | 1.38Å | 1.39Å | Aromatic |
| CAN | CAO | sing | 1.38Å | 1.38Å | Aromatic |
| CAL | H1 | sing | 1.08Å | 1.08Å | |
| CAN | H2 | sing | 1.08Å | 1.08Å | |
| CAO | H3 | sing | 1.08Å | 1.08Å | |
| CAP | H4 | sing | 1.08Å | 1.08Å | |
| NAJ | H5 | sing | 0.97Å | 1.00Å | |
| CAD | H6 | sing | 1.08Å | 1.08Å | |
| CAF | H7 | sing | 1.08Å | 1.08Å | |
| CAA | H8 | sing | 1.08Å | 1.08Å | |
| CAG | H9 | sing | 1.09Å | 1.10Å | |
| CAG | H10 | sing | 1.09Å | 1.10Å | |
| CAG | H11 | sing | 1.09Å | 1.10Å | |
| NBB | H12 | sing | 0.97Å | 1.00Å | |
| CAZ | H13 | sing | 1.08Å | 1.08Å | |
| CAY | H14 | sing | 1.08Å | 1.08Å | |
| CAX | H15 | sing | 1.08Å | 1.08Å | |
| CAW | H16 | sing | 1.08Å | 1.08Å | |
| CBC | H17 | sing | 1.08Å | 1.08Å | |
| CBD | H18 | sing | 1.08Å | 1.08Å | |
| CBE | H19 | sing | 1.08Å | 1.08Å | |
| CBG | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAX | CAY | CAZ | 117.6° | 120.9° |
| CAY | CAX | CAW | 121.0° | 121.1° |
| CAX | CAY | H14 | 121.2° | 119.6° |
| CAY | CAX | H15 | 119.5° | 119.4° |
| CAY | CAZ | C5 | 122.9° | 119.5° |
| CAY | CAZ | H13 | 118.6° | 120.2° |
| CAZ | CAY | H14 | 121.2° | 119.5° |
| CAX | CAW | C4 | 121.3° | 119.5° |
| CAW | CAX | H15 | 119.5° | 119.5° |
| CAX | CAW | H16 | 119.3° | 120.2° |
| CAZ | C5 | C4 | 116.6° | 119.6° |
| CAZ | C5 | C6 | 128.1° | 122.0° |
| C5 | CAZ | H13 | 118.5° | 120.2° |
| CAW | C4 | C5 | 120.6° | 119.4° |
| CAW | C4 | N3 | 119.1° | 121.9° |
| C4 | CAW | H16 | 119.4° | 120.2° |
| C4 | C5 | C6 | 115.3° | 118.3° |
| C5 | C4 | N3 | 120.3° | 118.8° |
| C5 | C6 | NBB | 120.5° | 120.9° |
| C5 | C6 | N1 | 120.3° | 118.3° |
| C4 | N3 | C2 | 123.1° | 120.4° |
| C6 | NBB | CAC | 123.3° | 120.0° |
| NBB | C6 | N1 | 119.2° | 120.8° |
| C6 | NBB | H12 | 118.3° | 120.0° |
| NBB | CAC | CAB | 118.4° | 120.1° |
| NBB | CAC | CAD | 121.0° | 120.0° |
| CAC | NBB | H12 | 118.3° | 120.0° |
| C6 | N1 | C2 | 122.4° | 121.4° |
| CAG | CAB | CAC | 122.0° | 119.9° |
| CAG | CAB | CAA | 121.2° | 119.8° |
| CAB | CAG | H9 | 109.5° | 109.5° |
| CAB | CAG | H10 | 109.5° | 109.5° |
| CAB | CAG | H11 | 109.5° | 109.5° |
| N3 | C2 | N1 | 118.6° | 122.7° |
| N3 | C2 | CBA | 125.4° | 118.7° |
| CAB | CAC | CAD | 120.5° | 120.0° |
| CAC | CAB | CAA | 116.8° | 120.3° |
| CAC | CAD | CAE | 122.6° | 119.8° |
| CAC | CAD | H6 | 118.7° | 120.1° |
| CAB | CAA | CAF | 123.2° | 120.2° |
| CAB | CAA | H8 | 118.4° | 119.9° |
| N1 | C2 | CBA | 115.9° | 118.6° |
| CAD | CAE | CAF | 117.0° | 119.8° |
| CAD | CAE | CAH | 119.3° | 120.1° |
| CAE | CAD | H6 | 118.7° | 120.1° |
| C2 | CBA | CBC | 119.6° | 120.5° |
| C2 | CBA | CBG | 119.7° | 120.6° |
| CAA | CAF | CAE | 119.8° | 120.0° |
| CAA | CAF | H7 | 120.1° | 120.0° |
| CAF | CAA | H8 | 118.4° | 119.9° |
| CAF | CAE | CAH | 123.6° | 120.1° |
| CAE | CAF | H7 | 120.1° | 120.0° |
| CAE | CAH | OAI | 118.7° | 120.0° |
| CAE | CAH | NAJ | 119.7° | 120.0° |
| OAI | CAH | NAJ | 121.1° | 120.0° |
| CBC | CBA | CBG | 120.6° | 118.9° |
| CBA | CBC | CBD | 119.0° | 118.3° |
| CBA | CBC | H17 | 120.5° | 120.9° |
| CBA | CBG | NBF | 120.5° | 120.6° |
| CBA | CBG | H20 | 119.8° | 119.7° |
| CAH | NAJ | CAK | 125.1° | 120.0° |
| CAH | NAJ | H5 | 117.5° | 120.0° |
| FBK | CBH | FBJ | 110.3° | 109.5° |
| FBK | CBH | FBI | 112.2° | 109.5° |
| FBK | CBH | CAM | 108.9° | 109.5° |
| CBC | CBD | CBE | 122.6° | 119.3° |
| CBD | CBC | H17 | 120.5° | 120.8° |
| CBC | CBD | H18 | 118.7° | 120.4° |
| CBG | NBF | CBE | 119.9° | 121.9° |
| NBF | CBG | H20 | 119.8° | 119.7° |
| FBJ | CBH | FBI | 108.7° | 109.4° |
| FBJ | CBH | CAM | 105.7° | 109.5° |
| FBI | CBH | CAM | 110.9° | 109.5° |
| CBH | CAM | CAL | 121.8° | 120.0° |
| CBH | CAM | CAN | 121.7° | 120.0° |
| CAK | CAL | CAM | 123.5° | 120.0° |
| CAL | CAK | NAJ | 125.8° | 120.1° |
| CAL | CAK | CAP | 116.5° | 119.8° |
| CAK | CAL | H1 | 118.2° | 120.0° |
| CAL | CAM | CAN | 116.5° | 120.1° |
| CAM | CAL | H1 | 118.3° | 120.1° |
| NAJ | CAK | CAP | 117.7° | 120.1° |
| CAK | NAJ | H5 | 117.4° | 120.1° |
| CBD | CBE | NBF | 117.4° | 121.0° |
| CBE | CBD | H18 | 118.7° | 120.3° |
| CBD | CBE | H19 | 121.3° | 119.5° |
| CAK | CAP | CAO | 122.0° | 119.9° |
| CAK | CAP | H4 | 119.0° | 120.0° |
| CAM | CAN | CAO | 121.8° | 120.1° |
| CAM | CAN | H2 | 119.1° | 119.9° |
| NBF | CBE | H19 | 121.3° | 119.5° |
| CAP | CAO | CAN | 119.6° | 120.1° |
| CAP | CAO | H3 | 120.2° | 119.9° |
| CAO | CAP | H4 | 119.0° | 120.1° |
| CAO | CAN | H2 | 119.1° | 119.9° |
| CAN | CAO | H3 | 120.2° | 120.0° |
| H9 | CAG | H10 | 109.5° | 109.5° |
| H9 | CAG | H11 | 109.4° | 109.5° |
| H10 | CAG | H11 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAX | CAY | CAZ | H14 | 180.0° | 180.0° |
| CAY | CAX | CAW | H15 | 180.0° | 179.9° |
| CAX | CAY | CAZ | C5 | 1.5° | 0.1° |
| CAY | CAX | CAW | C4 | 0.4° | 0.1° |
| CAX | CAY | CAZ | H13 | 178.5° | 180.0° |
| CAY | CAX | CAW | H16 | 179.5° | 180.0° |
| CAZ | CAY | CAX | CAW | 1.4° | 0.1° |
| CAY | CAZ | C5 | H13 | 180.0° | 179.9° |
| CAY | CAZ | C5 | C4 | 0.4° | 0.1° |
| CAY | CAZ | C5 | C6 | 178.6° | 180.0° |
| CAZ | CAY | CAX | H15 | 178.5° | 179.9° |
| CAX | CAW | C4 | H16 | 180.0° | 179.9° |
| CAX | CAW | C4 | C5 | 0.7° | 0.1° |
| CAX | CAW | C4 | N3 | 179.4° | 179.9° |
| CAW | CAX | CAY | H14 | 178.6° | 179.9° |
| CAZ | C5 | C4 | CAW | 0.6° | 0.1° |
| CAZ | C5 | C4 | C6 | 179.1° | 179.9° |
| CAZ | C5 | C4 | N3 | 179.4° | 180.0° |
| CAZ | C5 | C6 | NBB | 2.0° | 0.1° |
| CAZ | C5 | C6 | N1 | 179.5° | 179.8° |
| C5 | CAZ | CAY | H14 | 178.5° | 179.9° |
| CAW | C4 | C5 | N3 | 179.9° | 179.9° |
| CAW | C4 | C5 | C6 | 179.8° | 180.0° |
| CAW | C4 | N3 | C2 | 179.3° | 179.8° |
| C4 | CAW | CAX | H15 | 179.6° | 180.0° |
| C4 | C5 | C6 | NBB | 179.0° | 180.0° |
| C4 | C5 | C6 | N1 | 0.4° | 0.3° |
| C5 | C4 | N3 | C2 | 0.6° | 0.2° |
| C4 | C5 | CAZ | H13 | 179.6° | 180.0° |
| C5 | C4 | CAW | H16 | 179.4° | 180.0° |
| C6 | C5 | C4 | N3 | 0.3° | 0.1° |
| C5 | C6 | NBB | N1 | 178.6° | 179.7° |
| C5 | C6 | NBB | CAC | 167.6° | 173.3° |
| C5 | C6 | N1 | C2 | 0.3° | 0.3° |
| C5 | C6 | NBB | H12 | 12.4° | 6.6° |
| C6 | C5 | CAZ | H13 | 1.4° | 0.1° |
| C4 | N3 | C2 | N1 | 1.4° | 0.2° |
| C4 | N3 | C2 | CBA | 179.6° | 179.8° |
| N3 | C4 | CAW | H16 | 0.6° | 0.1° |
| C6 | NBB | CAC | H12 | 180.0° | 179.9° |
| C6 | NBB | CAC | CAB | 95.6° | 156.4° |
| C6 | NBB | CAC | CAD | 87.7° | 24.5° |
| NBB | C6 | N1 | C2 | 178.3° | 180.0° |
| CAC | NBB | C6 | N1 | 13.8° | 7.0° |
| NBB | CAC | CAB | CAG | 2.0° | 0.6° |
| NBB | CAC | CAB | CAD | 176.7° | 179.2° |
| NBB | CAC | CAB | CAA | 178.3° | 180.0° |
| NBB | CAC | CAD | CAE | 178.4° | 179.7° |
| NBB | CAC | CAD | H6 | 1.6° | 0.3° |
| C6 | N1 | C2 | N3 | 1.2° | 0.1° |
| C6 | N1 | C2 | CBA | 179.6° | 180.0° |
| N1 | C6 | NBB | H12 | 166.2° | 173.1° |
| CAG | CAB | CAC | CAA | 179.7° | 179.4° |
| CAG | CAB | CAC | CAD | 178.6° | 179.7° |
| CAG | CAB | CAA | CAF | 179.1° | 180.0° |
| CAG | CAB | CAA | H8 | 1.0° | 0.1° |
| CAB | CAG | H9 | H10 | 120.0° | 120.0° |
| CAB | CAG | H9 | H11 | 120.0° | 120.1° |
| CAB | CAG | H10 | H11 | 120.0° | 120.0° |
| N3 | C2 | N1 | CBA | 178.4° | 180.0° |
| N3 | C2 | CBA | CBC | 6.3° | 5.2° |
| N3 | C2 | CBA | CBG | 173.0° | 175.0° |
| CAB | CAC | CAD | CAE | 1.8° | 0.6° |
| CAC | CAB | CAA | CAF | 1.2° | 0.6° |
| CAB | CAC | CAD | H6 | 178.2° | 179.4° |
| CAC | CAB | CAA | H8 | 178.8° | 179.4° |
| CAC | CAB | CAG | H9 | 89.8° | 90.5° |
| CAC | CAB | CAG | H10 | 150.1° | 29.4° |
| CAC | CAB | CAG | H11 | 30.1° | 149.4° |
| CAB | CAC | NBB | H12 | 84.4° | 23.7° |
| CAD | CAC | CAB | CAA | 1.6° | 0.8° |
| CAC | CAD | CAE | H6 | 180.0° | 180.0° |
| CAC | CAD | CAE | CAF | 1.4° | 0.0° |
| CAC | CAD | CAE | CAH | 178.2° | 179.7° |
| CAD | CAC | NBB | H12 | 92.2° | 155.5° |
| CAB | CAA | CAF | H8 | 180.0° | 179.9° |
| CAB | CAA | CAF | CAE | 0.9° | 0.0° |
| CAB | CAA | CAF | H7 | 179.1° | 180.0° |
| CAA | CAB | CAG | H9 | 89.9° | 90.0° |
| CAA | CAB | CAG | H10 | 30.1° | 150.0° |
| CAA | CAB | CAG | H11 | 150.1° | 30.0° |
| N1 | C2 | CBA | CBC | 175.4° | 174.8° |
| N1 | C2 | CBA | CBG | 5.2° | 4.9° |
| CAD | CAE | CAF | CAA | 0.9° | 0.2° |
| CAD | CAE | CAF | CAH | 176.6° | 179.8° |
| CAD | CAE | CAH | OAI | 7.2° | 5.5° |
| CAD | CAE | CAH | NAJ | 179.3° | 174.5° |
| CAD | CAE | CAF | H7 | 179.1° | 179.7° |
| C2 | CBA | CBC | CBG | 179.4° | 179.7° |
| C2 | CBA | CBC | CBD | 179.5° | 180.0° |
| C2 | CBA | CBG | NBF | 179.4° | 179.8° |
| C2 | CBA | CBC | H17 | 0.5° | 0.0° |
| C2 | CBA | CBG | H20 | 0.6° | 0.0° |
| CAA | CAF | CAE | H7 | 180.0° | 180.0° |
| CAA | CAF | CAE | CAH | 177.5° | 180.0° |
| CAF | CAE | CAH | OAI | 169.4° | 174.8° |
| CAF | CAE | CAH | NAJ | 2.8° | 5.2° |
| CAF | CAE | CAD | H6 | 178.6° | 180.0° |
| CAE | CAF | CAA | H8 | 179.1° | 179.9° |
| CAE | CAH | OAI | NAJ | 172.0° | 180.0° |
| CAE | CAH | NAJ | CAK | 171.9° | 174.7° |
| CAE | CAH | NAJ | H5 | 8.1° | 5.4° |
| CAH | CAE | CAD | H6 | 1.8° | 0.3° |
| CAH | CAE | CAF | H7 | 2.5° | 0.0° |
| OAI | CAH | NAJ | CAK | 0.1° | 5.3° |
| OAI | CAH | NAJ | H5 | 179.9° | 174.6° |
| CBA | CBC | CBD | H17 | 180.0° | 180.0° |
| CBC | CBA | CBG | NBF | 0.0° | 0.5° |
| CBA | CBC | CBD | CBE | 0.2° | 0.0° |
| CBA | CBC | CBD | H18 | 179.8° | 180.0° |
| CBC | CBA | CBG | H20 | 180.0° | 179.8° |
| CBG | CBA | CBC | CBD | 0.2° | 0.2° |
| CBA | CBG | NBF | H20 | 180.0° | 179.8° |
| CBA | CBG | NBF | CBE | 0.1° | 0.5° |
| CBG | CBA | CBC | H17 | 179.9° | 179.8° |
| CAH | NAJ | CAK | CAL | 28.8° | 152.4° |
| CAH | NAJ | CAK | H5 | 180.0° | 180.0° |
| CAH | NAJ | CAK | CAP | 154.5° | 27.7° |
| FBK | CBH | FBJ | FBI | 123.4° | 120.0° |
| FBK | CBH | FBJ | CAM | 117.5° | 120.0° |
| FBK | CBH | FBI | CAM | 122.0° | 120.0° |
| FBK | CBH | CAM | CAL | 44.6° | 60.2° |
| FBK | CBH | CAM | CAN | 135.6° | 120.0° |
| CBC | CBD | CBE | H18 | 180.0° | 179.9° |
| CBC | CBD | CBE | NBF | 0.1° | 0.1° |
| CBC | CBD | CBE | H19 | 179.9° | 180.0° |
| CBG | NBF | CBE | CBD | 0.1° | 0.2° |
| CBG | NBF | CBE | H19 | 179.9° | 179.7° |
| FBJ | CBH | FBI | CAM | 115.8° | 119.9° |
| FBJ | CBH | CAM | CAL | 73.9° | 179.7° |
| FBJ | CBH | CAM | CAN | 105.9° | 0.1° |
| FBI | CBH | CAM | CAL | 168.5° | 59.8° |
| FBI | CBH | CAM | CAN | 11.7° | 120.0° |
| CBH | CAM | CAL | CAK | 178.3° | 180.0° |
| CBH | CAM | CAL | CAN | 179.8° | 179.8° |
| CBH | CAM | CAN | CAO | 177.8° | 180.0° |
| CBH | CAM | CAL | H1 | 1.7° | 0.0° |
| CBH | CAM | CAN | H2 | 2.2° | 0.1° |
| CAK | CAL | CAM | H1 | 180.0° | 180.0° |
| CAL | CAK | NAJ | CAP | 176.7° | 180.0° |
| CAK | CAL | CAM | CAN | 1.5° | 0.2° |
| CAL | CAK | CAP | CAO | 1.5° | 0.3° |
| CAL | CAK | CAP | H4 | 178.5° | 180.0° |
| CAL | CAK | NAJ | H5 | 151.2° | 27.6° |
| CAM | CAL | CAK | NAJ | 178.0° | 180.0° |
| CAM | CAL | CAK | CAP | 1.3° | 0.0° |
| CAL | CAM | CAN | CAO | 2.0° | 0.2° |
| CAL | CAM | CAN | H2 | 178.0° | 179.7° |
| NAJ | CAK | CAP | CAO | 178.6° | 179.7° |
| NAJ | CAK | CAL | H1 | 2.0° | 0.0° |
| NAJ | CAK | CAP | H4 | 1.4° | 0.0° |
| CBD | CBE | NBF | H19 | 180.0° | 179.9° |
| CBE | CBD | CBC | H17 | 179.8° | 180.0° |
| CAK | CAP | CAO | H4 | 180.0° | 179.7° |
| CAK | CAP | CAO | CAN | 2.1° | 0.3° |
| CAP | CAK | CAL | H1 | 178.8° | 180.0° |
| CAK | CAP | CAO | H3 | 177.9° | 179.8° |
| CAP | CAK | NAJ | H5 | 25.5° | 152.4° |
| CAM | CAN | CAO | CAP | 2.4° | 0.1° |
| CAM | CAN | CAO | H2 | 180.0° | 179.9° |
| CAN | CAM | CAL | H1 | 178.5° | 179.7° |
| CAM | CAN | CAO | H3 | 177.6° | 180.0° |
| NBF | CBE | CBD | H18 | 179.9° | 180.0° |
| CBE | NBF | CBG | H20 | 179.9° | 179.8° |
| CAP | CAO | CAN | H3 | 180.0° | 179.9° |
| CAP | CAO | CAN | H2 | 177.6° | 180.0° |
| CAN | CAO | CAP | H4 | 177.9° | 180.0° |
| H2 | CAN | CAO | H3 | 2.4° | 0.1° |
| H3 | CAO | CAP | H4 | 2.1° | 0.1° |
| H7 | CAF | CAA | H8 | 0.9° | 0.1° |
| H9 | CAG | H10 | H11 | 120.0° | 120.0° |
| H13 | CAZ | CAY | H14 | 1.4° | 0.0° |
| H14 | CAY | CAX | H15 | 1.4° | 0.0° |
| H15 | CAX | CAW | H16 | 0.5° | 0.1° |
| H17 | CBC | CBD | H18 | 0.2° | 0.0° |
| H18 | CBD | CBE | H19 | 0.1° | 0.1° |
