N5Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAW | CAX | doub | 1.38Å | 1.39Å | Aromatic |
| CAW | CAV | sing | 1.38Å | 1.40Å | Aromatic |
| CAX | CBA | sing | 1.38Å | 1.38Å | Aromatic |
| CBA | CAZ | doub | 1.38Å | 1.40Å | Aromatic |
| CAZ | CAY | sing | 1.38Å | 1.39Å | Aromatic |
| CAY | CAV | doub | 1.38Å | 1.39Å | Aromatic |
| CAV | CAU | sing | 1.51Å | 1.39Å | |
| CAU | NAN | sing | 1.46Å | 1.50Å | |
| NAN | CAO | sing | 1.38Å | 1.36Å | |
| NAN | CAM | sing | 1.35Å | 1.34Å | |
| CAO | NAP | sing | 1.37Å | 1.35Å | |
| CAO | CAF | doub | 1.38Å | 1.42Å | |
| CAM | OAL | doub | 1.22Å | 1.22Å | |
| CAM | NAD | sing | 1.34Å | 1.38Å | |
| NAD | CAE | sing | 1.35Å | 1.39Å | |
| CAE | OAA | doub | 1.22Å | 1.23Å | |
| CAE | CAF | sing | 1.41Å | 1.41Å | |
| CAF | NAG | sing | 1.41Å | 1.37Å | |
| NAG | CA0 | sing | 1.35Å | 1.34Å | |
| NAG | CAA | sing | 1.47Å | 1.48Å | |
| OAC | CA0 | doub | 1.22Å | 1.24Å | |
| CAI | CAJ | doub | 1.38Å | 1.39Å | Aromatic |
| CAI | CAR | sing | 1.38Å | 1.38Å | Aromatic |
| CAJ | CAK | sing | 1.38Å | 1.39Å | Aromatic |
| CA0 | CAT | sing | 1.48Å | 1.41Å | |
| CAK | CAT | doub | 1.40Å | 1.40Å | Aromatic |
| CAT | CAS | sing | 1.40Å | 1.39Å | Aromatic |
| CAS | CAR | doub | 1.38Å | 1.38Å | Aromatic |
| CAW | HAW | sing | 1.08Å | 1.08Å | |
| CAX | HAX | sing | 1.08Å | 1.08Å | |
| CBA | HBA | sing | 1.08Å | 1.08Å | |
| CAZ | HAZ | sing | 1.08Å | 1.08Å | |
| CAY | HAY | sing | 1.08Å | 1.08Å | |
| CAU | HAU1 | sing | 1.09Å | 1.10Å | |
| CAU | HAU2 | sing | 1.09Å | 1.10Å | |
| NAP | HAP1 | sing | 0.97Å | 1.00Å | |
| NAP | HAP2 | sing | 0.97Å | 1.00Å | |
| NAD | HAD | sing | 0.97Å | 1.00Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAR | HAR | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAS | HAS | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAX | CAW | CAV | 121.2° | 120.0° |
| CAW | CAX | CBA | 119.0° | 120.0° |
| CAX | CAW | HAW | 119.4° | 120.0° |
| CAW | CAX | HAX | 120.5° | 120.0° |
| CAW | CAV | CAY | 119.4° | 120.0° |
| CAW | CAV | CAU | 116.8° | 120.0° |
| CAV | CAW | HAW | 119.4° | 120.0° |
| CAX | CBA | CAZ | 120.1° | 120.0° |
| CBA | CAX | HAX | 120.5° | 120.0° |
| CAX | CBA | HBA | 119.9° | 120.0° |
| CBA | CAZ | CAY | 120.9° | 120.0° |
| CAZ | CBA | HBA | 120.0° | 120.0° |
| CBA | CAZ | HAZ | 119.6° | 120.0° |
| CAZ | CAY | CAV | 119.4° | 120.0° |
| CAY | CAZ | HAZ | 119.6° | 120.0° |
| CAZ | CAY | HAY | 120.3° | 120.0° |
| CAY | CAV | CAU | 123.8° | 120.0° |
| CAV | CAY | HAY | 120.3° | 120.0° |
| CAV | CAU | NAN | 120.1° | 109.5° |
| CAV | CAU | HAU1 | 106.7° | 109.5° |
| CAV | CAU | HAU2 | 106.8° | 109.5° |
| CAU | NAN | CAO | 121.7° | 119.8° |
| CAU | NAN | CAM | 117.9° | 119.8° |
| NAN | CAU | HAU1 | 106.7° | 109.5° |
| NAN | CAU | HAU2 | 106.7° | 109.4° |
| CAO | NAN | CAM | 120.1° | 120.4° |
| NAN | CAO | NAP | 121.3° | 120.4° |
| NAN | CAO | CAF | 120.3° | 119.2° |
| NAN | CAM | OAL | 119.7° | 119.4° |
| NAN | CAM | NAD | 121.7° | 121.2° |
| NAP | CAO | CAF | 118.3° | 120.4° |
| CAO | NAP | HAP1 | 109.5° | 120.0° |
| CAO | NAP | HAP2 | 109.5° | 120.0° |
| CAO | CAF | CAE | 119.1° | 118.9° |
| CAO | CAF | NAG | 121.1° | 120.5° |
| OAL | CAM | NAD | 118.6° | 119.4° |
| CAM | NAD | CAE | 120.7° | 120.8° |
| CAM | NAD | HAD | 119.7° | 119.6° |
| NAD | CAE | OAA | 118.0° | 120.3° |
| NAD | CAE | CAF | 117.8° | 119.5° |
| CAE | NAD | HAD | 119.6° | 119.6° |
| OAA | CAE | CAF | 124.2° | 120.2° |
| CAE | CAF | NAG | 119.5° | 120.6° |
| CAF | NAG | CA0 | 128.6° | 120.0° |
| CAF | NAG | CAA | 116.2° | 120.0° |
| CA0 | NAG | CAA | 114.2° | 120.0° |
| NAG | CA0 | OAC | 119.8° | 120.0° |
| NAG | CA0 | CAT | 120.4° | 120.0° |
| NAG | CAA | HAA1 | 109.5° | 109.5° |
| NAG | CAA | HAA2 | 109.5° | 109.5° |
| NAG | CAA | HAA3 | 109.5° | 109.4° |
| OAC | CA0 | CAT | 119.8° | 120.0° |
| CAJ | CAI | CAR | 119.1° | 120.3° |
| CAI | CAJ | CAK | 119.9° | 120.1° |
| CAJ | CAI | HAI | 120.5° | 119.8° |
| CAI | CAJ | HAJ | 120.0° | 120.0° |
| CAI | CAR | CAS | 121.4° | 120.1° |
| CAR | CAI | HAI | 120.5° | 119.8° |
| CAI | CAR | HAR | 119.3° | 119.9° |
| CAJ | CAK | CAT | 120.7° | 119.9° |
| CAK | CAJ | HAJ | 120.1° | 119.9° |
| CAJ | CAK | HAK | 119.7° | 120.0° |
| CA0 | CAT | CAK | 123.9° | 120.1° |
| CA0 | CAT | CAS | 117.3° | 120.2° |
| CAK | CAT | CAS | 118.7° | 119.7° |
| CAT | CAK | HAK | 119.6° | 120.1° |
| CAT | CAS | CAR | 120.2° | 119.9° |
| CAT | CAS | HAS | 119.9° | 120.0° |
| CAS | CAR | HAR | 119.3° | 120.0° |
| CAR | CAS | HAS | 119.9° | 120.1° |
| HAU1 | CAU | HAU2 | 109.5° | 109.5° |
| HAP1 | NAP | HAP2 | 109.5° | 120.0° |
| HAA1 | CAA | HAA2 | 109.4° | 109.6° |
| HAA1 | CAA | HAA3 | 109.5° | 109.4° |
| HAA2 | CAA | HAA3 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAX | CAW | CAV | HAW | 180.0° | 179.9° |
| CAW | CAX | CBA | HAX | 180.0° | 180.0° |
| CAW | CAX | CBA | CAZ | 0.7° | 0.1° |
| CAX | CAW | CAV | CAY | 1.4° | 0.0° |
| CAX | CAW | CAV | CAU | 179.5° | 179.8° |
| CAW | CAX | CBA | HBA | 179.3° | 180.0° |
| CAV | CAW | CAX | CBA | 1.1° | 0.0° |
| CAW | CAV | CAY | CAZ | 1.2° | 0.0° |
| CAW | CAV | CAY | CAU | 178.0° | 179.8° |
| CAW | CAV | CAU | NAN | 146.6° | 90.3° |
| CAV | CAW | CAX | HAX | 178.9° | 180.0° |
| CAW | CAV | CAY | HAY | 178.8° | 179.8° |
| CAW | CAV | CAU | HAU1 | 25.1° | 29.8° |
| CAW | CAV | CAU | HAU2 | 91.9° | 149.8° |
| CAX | CBA | CAZ | HBA | 180.0° | 179.9° |
| CAX | CBA | CAZ | CAY | 0.5° | 0.1° |
| CBA | CAX | CAW | HAW | 178.9° | 180.0° |
| CAX | CBA | CAZ | HAZ | 179.5° | 180.0° |
| CBA | CAZ | CAY | HAZ | 180.0° | 179.9° |
| CBA | CAZ | CAY | CAV | 0.8° | 0.1° |
| CAZ | CBA | CAX | HAX | 179.3° | 179.9° |
| CBA | CAZ | CAY | HAY | 179.2° | 179.7° |
| CAZ | CAY | CAV | HAY | 180.0° | 179.8° |
| CAZ | CAY | CAV | CAU | 179.2° | 179.8° |
| CAY | CAZ | CBA | HBA | 179.4° | 180.0° |
| CAY | CAV | CAU | NAN | 35.4° | 90.0° |
| CAY | CAV | CAW | HAW | 178.6° | 179.9° |
| CAV | CAY | CAZ | HAZ | 179.3° | 180.0° |
| CAY | CAV | CAU | HAU1 | 156.9° | 150.0° |
| CAY | CAV | CAU | HAU2 | 86.2° | 30.0° |
| CAV | CAU | NAN | HAU1 | 121.5° | 120.0° |
| CAV | CAU | NAN | HAU2 | 121.5° | 120.0° |
| CAV | CAU | NAN | CAO | 102.9° | 90.0° |
| CAV | CAU | NAN | CAM | 83.0° | 90.3° |
| CAU | CAV | CAW | HAW | 0.5° | 0.3° |
| CAU | CAV | CAY | HAY | 0.8° | 0.0° |
| CAV | CAU | HAU1 | HAU2 | 115.2° | 120.0° |
| CAU | NAN | CAO | CAM | 174.0° | 179.7° |
| CAU | NAN | CAO | NAP | 4.6° | 0.0° |
| CAU | NAN | CAO | CAF | 178.6° | 180.0° |
| CAU | NAN | CAM | OAL | 3.6° | 0.0° |
| CAU | NAN | CAM | NAD | 177.3° | 180.0° |
| NAN | CAU | HAU1 | HAU2 | 115.2° | 120.0° |
| NAN | CAO | NAP | CAF | 176.9° | 180.0° |
| CAO | NAN | CAM | OAL | 177.8° | 179.7° |
| CAO | NAN | CAM | NAD | 3.1° | 0.3° |
| NAN | CAO | CAF | CAE | 4.6° | 0.0° |
| NAN | CAO | CAF | NAG | 177.9° | 180.0° |
| CAO | NAN | CAU | HAU1 | 18.6° | 30.0° |
| CAO | NAN | CAU | HAU2 | 135.6° | 150.0° |
| NAN | CAO | NAP | HAP1 | 180.0° | 8.3° |
| NAN | CAO | NAP | HAP2 | 60.0° | 171.6° |
| CAM | NAN | CAO | NAP | 178.6° | 179.7° |
| CAM | NAN | CAO | CAF | 4.6° | 0.3° |
| NAN | CAM | OAL | NAD | 179.1° | 180.0° |
| NAN | CAM | NAD | CAE | 1.6° | 0.0° |
| CAM | NAN | CAU | HAU1 | 155.5° | 149.7° |
| CAM | NAN | CAU | HAU2 | 38.5° | 29.7° |
| NAN | CAM | NAD | HAD | 178.5° | 180.0° |
| NAP | CAO | CAF | CAE | 178.5° | 179.9° |
| NAP | CAO | CAF | NAG | 5.2° | 0.0° |
| CAO | NAP | HAP1 | HAP2 | 120.0° | 179.9° |
| CAO | CAF | CAE | NAD | 3.0° | 0.2° |
| CAO | CAF | CAE | OAA | 179.5° | 179.9° |
| CAO | CAF | CAE | NAG | 173.4° | 179.9° |
| CAO | CAF | NAG | CA0 | 123.8° | 61.3° |
| CAO | CAF | NAG | CAA | 68.7° | 118.7° |
| CAF | CAO | NAP | HAP1 | 3.1° | 171.7° |
| CAF | CAO | NAP | HAP2 | 116.9° | 8.4° |
| OAL | CAM | NAD | CAE | 179.3° | 180.0° |
| OAL | CAM | NAD | HAD | 0.7° | 0.0° |
| CAM | NAD | CAE | HAD | 180.0° | 180.0° |
| CAM | NAD | CAE | OAA | 179.2° | 180.0° |
| CAM | NAD | CAE | CAF | 1.5° | 0.3° |
| NAD | CAE | OAA | CAF | 177.5° | 179.7° |
| NAD | CAE | CAF | NAG | 176.4° | 179.7° |
| OAA | CAE | CAF | NAG | 6.1° | 0.0° |
| OAA | CAE | NAD | HAD | 0.8° | 0.1° |
| CAE | CAF | NAG | CA0 | 62.9° | 118.6° |
| CAE | CAF | NAG | CAA | 104.6° | 61.3° |
| CAF | CAE | NAD | HAD | 178.5° | 179.8° |
| CAF | NAG | CA0 | CAA | 167.7° | 180.0° |
| CAF | NAG | CA0 | OAC | 173.1° | 176.8° |
| CAF | NAG | CA0 | CAT | 8.7° | 3.2° |
| CAF | NAG | CAA | HAA1 | 180.0° | 95.4° |
| CAF | NAG | CAA | HAA2 | 60.0° | 144.5° |
| CAF | NAG | CAA | HAA3 | 60.0° | 24.6° |
| NAG | CA0 | OAC | CAT | 178.2° | 180.0° |
| NAG | CA0 | CAT | CAK | 36.5° | 24.3° |
| NAG | CA0 | CAT | CAS | 145.4° | 155.4° |
| CA0 | NAG | CAA | HAA1 | 10.7° | 84.7° |
| CA0 | NAG | CAA | HAA2 | 130.7° | 35.5° |
| CA0 | NAG | CAA | HAA3 | 109.3° | 155.4° |
| CAA | NAG | CA0 | OAC | 5.4° | 3.2° |
| CAA | NAG | CA0 | CAT | 176.4° | 176.8° |
| NAG | CAA | HAA1 | HAA2 | 120.0° | 120.1° |
| NAG | CAA | HAA1 | HAA3 | 120.0° | 119.9° |
| NAG | CAA | HAA2 | HAA3 | 120.0° | 119.9° |
| OAC | CA0 | CAT | CAK | 141.7° | 155.7° |
| OAC | CA0 | CAT | CAS | 36.4° | 24.5° |
| CAJ | CAI | CAR | HAI | 180.0° | 179.7° |
| CAI | CAJ | CAK | HAJ | 180.0° | 179.7° |
| CAI | CAJ | CAK | CAT | 0.3° | 0.6° |
| CAJ | CAI | CAR | CAS | 0.4° | 0.1° |
| CAJ | CAI | CAR | HAR | 179.6° | 180.0° |
| CAI | CAJ | CAK | HAK | 179.7° | 180.0° |
| CAR | CAI | CAJ | CAK | 0.0° | 0.3° |
| CAI | CAR | CAS | CAT | 1.1° | 0.0° |
| CAI | CAR | CAS | HAR | 180.0° | 180.0° |
| CAR | CAI | CAJ | HAJ | 180.0° | 180.0° |
| CAI | CAR | CAS | HAS | 178.9° | 180.0° |
| CAJ | CAK | CAT | CA0 | 179.0° | 179.7° |
| CAJ | CAK | CAT | HAK | 180.0° | 179.5° |
| CAJ | CAK | CAT | CAS | 1.0° | 0.5° |
| CAK | CAJ | CAI | HAI | 180.0° | 180.0° |
| CA0 | CAT | CAK | CAS | 178.0° | 179.7° |
| CA0 | CAT | CAS | CAR | 179.5° | 180.0° |
| CA0 | CAT | CAK | HAK | 1.0° | 0.3° |
| CA0 | CAT | CAS | HAS | 0.5° | 0.0° |
| CAK | CAT | CAS | CAR | 1.4° | 0.2° |
| CAT | CAK | CAJ | HAJ | 179.7° | 179.8° |
| CAK | CAT | CAS | HAS | 178.6° | 179.7° |
| CAT | CAS | CAR | HAS | 180.0° | 180.0° |
| CAT | CAS | CAR | HAR | 178.9° | 180.0° |
| CAS | CAT | CAK | HAK | 179.0° | 180.0° |
| CAS | CAR | CAI | HAI | 179.6° | 179.7° |
| HAW | CAW | CAX | HAX | 1.1° | 0.1° |
| HAX | CAX | CBA | HBA | 0.7° | 0.0° |
| HBA | CBA | CAZ | HAZ | 0.5° | 0.1° |
| HAZ | CAZ | CAY | HAY | 0.7° | 0.2° |
| HAA1 | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| HAI | CAI | CAJ | HAJ | 0.0° | 0.3° |
| HAI | CAI | CAR | HAR | 0.4° | 0.3° |
| HAJ | CAJ | CAK | HAK | 0.3° | 0.3° |
| HAR | CAR | CAS | HAS | 1.1° | 0.0° |
