YCF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAA | CAK | doub | 1.30Å | 1.33Å | |
| NAB | CAK | sing | 1.38Å | 1.32Å | |
| NAB | OBE | sing | 1.42Å | 1.36Å | |
| NAC | NAD | sing | 1.40Å | 1.24Å | |
| NAC | CAK | sing | 1.38Å | 1.34Å | |
| NAD | CAL | doub | 1.30Å | 1.34Å | |
| NAE | CAQ | sing | 1.40Å | 1.36Å | |
| NAE | CAT | sing | 1.35Å | 1.35Å | |
| NAF | CAT | sing | 1.35Å | 1.35Å | |
| NAF | CAU | sing | 1.40Å | 1.36Å | |
| NAG | NAH | sing | 1.40Å | 1.24Å | |
| NAG | CBA | doub | 1.30Å | 1.35Å | |
| NAH | CBC | sing | 1.38Å | 1.34Å | |
| NAI | CBC | doub | 1.30Å | 1.32Å | |
| NAI | OBF | sing | 1.42Å | 1.37Å | |
| NAJ | CBC | sing | 1.38Å | 1.34Å | |
| CAL | CAM | sing | 1.51Å | 1.53Å | |
| CAL | CAN | sing | 1.47Å | 1.40Å | |
| CAN | CAO | doub | 1.40Å | 1.39Å | Aromatic |
| CAN | CAS | sing | 1.40Å | 1.40Å | Aromatic |
| CAO | CAP | sing | 1.38Å | 1.41Å | Aromatic |
| CAP | CAQ | doub | 1.39Å | 1.40Å | Aromatic |
| CAQ | CAR | sing | 1.39Å | 1.40Å | Aromatic |
| CAR | CAS | doub | 1.38Å | 1.39Å | Aromatic |
| CAT | OBD | doub | 1.22Å | 1.23Å | |
| CAU | CAV | doub | 1.39Å | 1.40Å | Aromatic |
| CAU | CAZ | sing | 1.39Å | 1.40Å | Aromatic |
| CAV | CAW | sing | 1.38Å | 1.41Å | Aromatic |
| CAW | CAX | doub | 1.40Å | 1.41Å | Aromatic |
| CAX | CAY | sing | 1.40Å | 1.40Å | Aromatic |
| CAX | CBA | sing | 1.47Å | 1.41Å | |
| CAY | CAZ | doub | 1.38Å | 1.39Å | Aromatic |
| CBA | CBB | sing | 1.51Å | 1.54Å | |
| NAA | HNAA | sing | 0.97Å | 1.00Å | |
| NAB | HNAB | sing | 0.97Å | 1.00Å | |
| NAC | HNAC | sing | 0.97Å | 1.00Å | |
| NAE | HNAE | sing | 0.97Å | 1.00Å | |
| NAF | HNAF | sing | 0.97Å | 1.00Å | |
| NAH | HNAH | sing | 0.97Å | 1.00Å | |
| NAJ | HNAJ | sing | 0.97Å | 1.00Å | |
| NAJ | HNAD | sing | 0.97Å | 1.00Å | |
| CAM | HAM | sing | 1.09Å | 1.10Å | |
| CAM | HAMA | sing | 1.09Å | 1.10Å | |
| CAM | HAMB | sing | 1.09Å | 1.10Å | |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| CAR | HAR | sing | 1.08Å | 1.08Å | |
| CAS | HAS | sing | 1.08Å | 1.08Å | |
| CAV | HAV | sing | 1.08Å | 1.08Å | |
| CAW | HAW | sing | 1.08Å | 1.08Å | |
| CAY | HAY | sing | 1.08Å | 1.08Å | |
| CAZ | HAZ | sing | 1.08Å | 1.08Å | |
| CBB | HBB | sing | 1.09Å | 1.10Å | |
| CBB | HBBA | sing | 1.09Å | 1.10Å | |
| CBB | HBBB | sing | 1.09Å | 1.10Å | |
| OBE | HOBE | sing | 0.97Å | 0.95Å | |
| OBF | HOBF | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAA | CAK | NAB | 119.0° | 120.0° |
| NAA | CAK | NAC | 121.6° | 120.0° |
| CAK | NAA | HNAA | 112.0° | 120.0° |
| CAK | NAB | OBE | 119.2° | 120.0° |
| NAB | CAK | NAC | 119.4° | 120.0° |
| CAK | NAB | HNAB | 120.4° | 120.0° |
| OBE | NAB | HNAB | 120.4° | 120.0° |
| NAB | OBE | HOBE | 109.5° | 114.0° |
| NAD | NAC | CAK | 119.8° | 120.0° |
| NAC | NAD | CAL | 124.2° | 120.0° |
| NAD | NAC | HNAC | 120.1° | 120.0° |
| CAK | NAC | HNAC | 120.1° | 120.0° |
| NAD | CAL | CAM | 121.0° | 120.0° |
| NAD | CAL | CAN | 116.1° | 120.0° |
| CAQ | NAE | CAT | 129.5° | 120.0° |
| NAE | CAQ | CAP | 125.3° | 119.9° |
| NAE | CAQ | CAR | 115.9° | 119.9° |
| CAQ | NAE | HNAE | 115.3° | 120.0° |
| NAE | CAT | NAF | 113.3° | 120.0° |
| NAE | CAT | OBD | 123.5° | 120.0° |
| CAT | NAE | HNAE | 115.2° | 120.0° |
| CAT | NAF | CAU | 129.8° | 120.0° |
| NAF | CAT | OBD | 123.1° | 120.0° |
| CAT | NAF | HNAF | 115.1° | 120.0° |
| NAF | CAU | CAV | 125.7° | 119.9° |
| NAF | CAU | CAZ | 116.2° | 119.9° |
| CAU | NAF | HNAF | 115.1° | 120.0° |
| NAH | NAG | CBA | 124.6° | 120.0° |
| NAG | NAH | CBC | 118.8° | 120.0° |
| NAG | NAH | HNAH | 120.6° | 120.0° |
| NAG | CBA | CAX | 119.5° | 120.0° |
| NAG | CBA | CBB | 119.7° | 120.0° |
| NAH | CBC | NAI | 119.5° | 120.0° |
| NAH | CBC | NAJ | 121.9° | 120.0° |
| CBC | NAH | HNAH | 120.6° | 120.0° |
| CBC | NAI | OBF | 120.2° | 120.0° |
| NAI | CBC | NAJ | 118.5° | 120.0° |
| NAI | OBF | HOBF | 109.5° | 114.0° |
| CBC | NAJ | HNAJ | 120.0° | 120.0° |
| CBC | NAJ | HNAD | 120.0° | 120.0° |
| CAM | CAL | CAN | 122.7° | 120.0° |
| CAL | CAM | HAM | 109.5° | 109.5° |
| CAL | CAM | HAMA | 109.5° | 109.4° |
| CAL | CAM | HAMB | 109.5° | 109.5° |
| CAL | CAN | CAO | 122.5° | 120.1° |
| CAL | CAN | CAS | 118.2° | 120.1° |
| CAO | CAN | CAS | 119.2° | 119.8° |
| CAN | CAO | CAP | 119.7° | 119.9° |
| CAN | CAO | HAO | 120.1° | 120.0° |
| CAN | CAS | CAR | 121.2° | 119.9° |
| CAN | CAS | HAS | 119.4° | 120.1° |
| CAO | CAP | CAQ | 120.9° | 120.0° |
| CAP | CAO | HAO | 120.2° | 120.0° |
| CAO | CAP | HAP | 119.5° | 120.0° |
| CAP | CAQ | CAR | 118.9° | 120.2° |
| CAQ | CAP | HAP | 119.5° | 120.0° |
| CAQ | CAR | CAS | 120.2° | 120.1° |
| CAQ | CAR | HAR | 119.9° | 120.0° |
| CAS | CAR | HAR | 119.9° | 120.0° |
| CAR | CAS | HAS | 119.4° | 120.0° |
| CAV | CAU | CAZ | 118.0° | 120.2° |
| CAU | CAV | CAW | 120.5° | 120.1° |
| CAU | CAV | HAV | 119.8° | 119.9° |
| CAU | CAZ | CAY | 121.8° | 120.1° |
| CAU | CAZ | HAZ | 119.1° | 120.0° |
| CAV | CAW | CAX | 120.9° | 119.9° |
| CAW | CAV | HAV | 119.7° | 120.0° |
| CAV | CAW | HAW | 119.5° | 120.1° |
| CAW | CAX | CAY | 118.2° | 119.8° |
| CAW | CAX | CBA | 122.1° | 120.1° |
| CAX | CAW | HAW | 119.6° | 120.0° |
| CAY | CAX | CBA | 119.7° | 120.1° |
| CAX | CAY | CAZ | 120.5° | 119.9° |
| CAX | CAY | HAY | 119.8° | 120.0° |
| CAX | CBA | CBB | 120.6° | 120.0° |
| CAZ | CAY | HAY | 119.7° | 120.0° |
| CAY | CAZ | HAZ | 119.1° | 120.0° |
| CBA | CBB | HBB | 109.5° | 109.5° |
| CBA | CBB | HBBA | 109.4° | 109.5° |
| CBA | CBB | HBBB | 109.5° | 109.5° |
| HNAJ | NAJ | HNAD | 120.0° | 120.0° |
| HAM | CAM | HAMA | 109.5° | 109.4° |
| HAM | CAM | HAMB | 109.4° | 109.5° |
| HAMA | CAM | HAMB | 109.5° | 109.5° |
| HBB | CBB | HBBA | 109.5° | 109.5° |
| HBB | CBB | HBBB | 109.4° | 109.5° |
| HBBA | CBB | HBBB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAA | CAK | NAB | NAC | 179.3° | 179.9° |
| NAA | CAK | NAB | OBE | 0.5° | 0.0° |
| NAA | CAK | NAC | NAD | 0.6° | 0.0° |
| NAA | CAK | NAB | HNAB | 179.5° | 180.0° |
| NAA | CAK | NAC | HNAC | 179.4° | 180.0° |
| CAK | NAB | OBE | HNAB | 180.0° | 180.0° |
| NAB | CAK | NAC | NAD | 179.9° | 180.0° |
| NAB | CAK | NAA | HNAA | 179.3° | 180.0° |
| NAB | CAK | NAC | HNAC | 0.1° | 0.0° |
| CAK | NAB | OBE | HOBE | 180.0° | 180.0° |
| OBE | NAB | CAK | NAC | 179.8° | 180.0° |
| NAD | NAC | CAK | HNAC | 180.0° | 180.0° |
| NAC | NAD | CAL | CAM | 3.4° | 0.1° |
| NAC | NAD | CAL | CAN | 178.5° | 180.0° |
| CAK | NAC | NAD | CAL | 179.1° | 179.9° |
| NAC | CAK | NAA | HNAA | 0.0° | 0.0° |
| NAC | CAK | NAB | HNAB | 0.2° | 0.0° |
| NAD | CAL | CAM | CAN | 174.8° | 179.9° |
| NAD | CAL | CAN | CAO | 153.7° | 0.0° |
| NAD | CAL | CAN | CAS | 23.5° | 179.6° |
| CAL | NAD | NAC | HNAC | 0.9° | 0.1° |
| NAD | CAL | CAM | HAM | 180.0° | 90.1° |
| NAD | CAL | CAM | HAMA | 60.0° | 150.0° |
| NAD | CAL | CAM | HAMB | 60.0° | 30.0° |
| CAQ | NAE | CAT | HNAE | 180.0° | 179.9° |
| CAQ | NAE | CAT | NAF | 177.6° | 175.4° |
| NAE | CAQ | CAP | CAO | 179.8° | 180.0° |
| NAE | CAQ | CAP | CAR | 179.7° | 180.0° |
| NAE | CAQ | CAR | CAS | 179.6° | 179.7° |
| CAQ | NAE | CAT | OBD | 1.8° | 4.5° |
| NAE | CAQ | CAP | HAP | 0.2° | 0.0° |
| NAE | CAQ | CAR | HAR | 0.4° | 0.0° |
| NAE | CAT | NAF | OBD | 175.8° | 179.9° |
| NAE | CAT | NAF | CAU | 169.8° | 175.4° |
| CAT | NAE | CAQ | CAP | 19.1° | 144.9° |
| CAT | NAE | CAQ | CAR | 160.6° | 35.1° |
| NAE | CAT | NAF | HNAF | 10.2° | 4.5° |
| CAT | NAF | CAU | HNAF | 180.0° | 179.9° |
| CAT | NAF | CAU | CAV | 7.1° | 144.9° |
| CAT | NAF | CAU | CAZ | 169.4° | 35.4° |
| NAF | CAT | NAE | HNAE | 2.4° | 4.7° |
| CAU | NAF | CAT | OBD | 14.4° | 4.7° |
| NAF | CAU | CAV | CAZ | 176.5° | 179.7° |
| NAF | CAU | CAV | CAW | 178.0° | 180.0° |
| NAF | CAU | CAZ | CAY | 178.7° | 179.7° |
| NAF | CAU | CAV | HAV | 2.0° | 0.0° |
| NAF | CAU | CAZ | HAZ | 1.3° | 0.0° |
| NAG | NAH | CBC | HNAH | 180.0° | 179.9° |
| NAG | NAH | CBC | NAI | 2.0° | 0.0° |
| NAG | NAH | CBC | NAJ | 178.9° | 180.0° |
| NAH | NAG | CBA | CAX | 178.9° | 180.0° |
| NAH | NAG | CBA | CBB | 3.2° | 0.0° |
| CBA | NAG | NAH | CBC | 178.3° | 180.0° |
| NAG | CBA | CAX | CAW | 152.4° | 0.0° |
| NAG | CBA | CAX | CAY | 27.1° | 180.0° |
| NAG | CBA | CAX | CBB | 175.7° | 180.0° |
| CBA | NAG | NAH | HNAH | 1.6° | 0.1° |
| NAG | CBA | CBB | HBB | 180.0° | 90.0° |
| NAG | CBA | CBB | HBBA | 60.0° | 150.0° |
| NAG | CBA | CBB | HBBB | 60.0° | 30.0° |
| NAH | CBC | NAI | NAJ | 177.0° | 180.0° |
| NAH | CBC | NAI | OBF | 178.0° | 180.0° |
| NAH | CBC | NAJ | HNAJ | 176.9° | 0.0° |
| NAH | CBC | NAJ | HNAD | 3.1° | 180.0° |
| NAI | CBC | NAH | HNAH | 178.1° | 180.0° |
| NAI | CBC | NAJ | HNAJ | 0.0° | 180.0° |
| NAI | CBC | NAJ | HNAD | 180.0° | 0.0° |
| CBC | NAI | OBF | HOBF | 180.0° | 179.9° |
| OBF | NAI | CBC | NAJ | 0.9° | 0.0° |
| NAJ | CBC | NAH | HNAH | 1.2° | 0.0° |
| CBC | NAJ | HNAJ | HNAD | 180.0° | 180.0° |
| CAM | CAL | CAN | CAO | 21.3° | 179.9° |
| CAM | CAL | CAN | CAS | 161.4° | 0.3° |
| CAL | CAM | HAM | HAMA | 120.0° | 119.9° |
| CAL | CAM | HAM | HAMB | 120.0° | 120.1° |
| CAL | CAM | HAMA | HAMB | 120.0° | 120.0° |
| CAL | CAN | CAO | CAS | 177.3° | 179.6° |
| CAL | CAN | CAO | CAP | 178.6° | 180.0° |
| CAL | CAN | CAS | CAR | 178.1° | 179.7° |
| CAN | CAL | CAM | HAM | 5.2° | 90.0° |
| CAN | CAL | CAM | HAMA | 125.2° | 30.0° |
| CAN | CAL | CAM | HAMB | 114.7° | 150.0° |
| CAL | CAN | CAO | HAO | 1.3° | 0.1° |
| CAL | CAN | CAS | HAS | 1.8° | 0.1° |
| CAN | CAO | CAP | HAO | 180.0° | 179.9° |
| CAN | CAO | CAP | CAQ | 1.0° | 0.0° |
| CAO | CAN | CAS | CAR | 0.8° | 0.6° |
| CAN | CAO | CAP | HAP | 179.0° | 179.9° |
| CAO | CAN | CAS | HAS | 179.2° | 179.7° |
| CAS | CAN | CAO | CAP | 1.4° | 0.3° |
| CAN | CAS | CAR | CAQ | 0.3° | 0.6° |
| CAN | CAS | CAR | HAS | 180.0° | 179.7° |
| CAS | CAN | CAO | HAO | 178.6° | 179.8° |
| CAN | CAS | CAR | HAR | 179.7° | 179.7° |
| CAO | CAP | CAQ | HAP | 180.0° | 179.9° |
| CAO | CAP | CAQ | CAR | 0.0° | 0.0° |
| CAP | CAQ | CAR | CAS | 0.7° | 0.3° |
| CAP | CAQ | NAE | HNAE | 160.8° | 35.2° |
| CAQ | CAP | CAO | HAO | 179.0° | 179.9° |
| CAP | CAQ | CAR | HAR | 179.3° | 180.0° |
| CAQ | CAR | CAS | HAR | 180.0° | 179.7° |
| CAR | CAQ | NAE | HNAE | 19.4° | 144.8° |
| CAR | CAQ | CAP | HAP | 179.9° | 180.0° |
| CAQ | CAR | CAS | HAS | 179.7° | 179.7° |
| OBD | CAT | NAE | HNAE | 178.1° | 175.4° |
| OBD | CAT | NAF | HNAF | 165.6° | 175.4° |
| CAU | CAV | CAW | HAV | 180.0° | 180.0° |
| CAU | CAV | CAW | CAX | 0.7° | 0.0° |
| CAV | CAU | CAZ | CAY | 1.9° | 0.5° |
| CAV | CAU | NAF | HNAF | 172.8° | 35.1° |
| CAU | CAV | CAW | HAW | 179.3° | 180.0° |
| CAV | CAU | CAZ | HAZ | 178.2° | 179.7° |
| CAZ | CAU | CAV | CAW | 1.5° | 0.3° |
| CAU | CAZ | CAY | CAX | 1.3° | 0.5° |
| CAU | CAZ | CAY | HAZ | 180.0° | 179.8° |
| CAZ | CAU | NAF | HNAF | 10.6° | 144.7° |
| CAZ | CAU | CAV | HAV | 178.5° | 179.7° |
| CAU | CAZ | CAY | HAY | 178.7° | 179.7° |
| CAV | CAW | CAX | HAW | 180.0° | 180.0° |
| CAV | CAW | CAX | CAY | 0.1° | 0.0° |
| CAV | CAW | CAX | CBA | 179.4° | 180.0° |
| CAW | CAX | CAY | CBA | 179.5° | 180.0° |
| CAW | CAX | CAY | CAZ | 0.4° | 0.2° |
| CAW | CAX | CBA | CBB | 23.3° | 180.0° |
| CAX | CAW | CAV | HAV | 179.3° | 180.0° |
| CAW | CAX | CAY | HAY | 179.6° | 180.0° |
| CAX | CAY | CAZ | HAY | 180.0° | 179.8° |
| CAY | CAX | CBA | CBB | 157.2° | 0.0° |
| CAY | CAX | CAW | HAW | 179.9° | 180.0° |
| CAX | CAY | CAZ | HAZ | 178.7° | 179.7° |
| CBA | CAX | CAY | CAZ | 179.1° | 179.8° |
| CBA | CAX | CAW | HAW | 0.6° | 0.0° |
| CBA | CAX | CAY | HAY | 0.9° | 0.0° |
| CAX | CBA | CBB | HBB | 4.3° | 90.0° |
| CAX | CBA | CBB | HBBA | 115.7° | 30.0° |
| CAX | CBA | CBB | HBBB | 124.3° | 150.0° |
| CBA | CBB | HBB | HBBA | 120.0° | 120.0° |
| CBA | CBB | HBB | HBBB | 120.0° | 120.0° |
| CBA | CBB | HBBA | HBBB | 120.0° | 120.0° |
| HNAB | NAB | OBE | HOBE | 0.0° | 0.0° |
| HAM | CAM | HAMA | HAMB | 120.0° | 120.0° |
| HAO | CAO | CAP | HAP | 1.0° | 0.0° |
| HAR | CAR | CAS | HAS | 0.3° | 0.1° |
| HAV | CAV | CAW | HAW | 0.7° | 0.0° |
| HAY | CAY | CAZ | HAZ | 1.3° | 0.0° |
| HBB | CBB | HBBA | HBBB | 120.0° | 120.0° |
