D15
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAO | CAY | sing | 1.40Å | 1.40Å | Aromatic |
| CAO | CBB | doub | 1.38Å | 1.38Å | Aromatic |
| CAY | CL1 | sing | 1.72Å | 1.72Å | |
| CAY | CAI | doub | 1.37Å | 1.37Å | Aromatic |
| CAI | CAH | sing | 1.36Å | 1.36Å | Aromatic |
| CAH | CAL | doub | 1.37Å | 1.37Å | Aromatic |
| CAL | CBB | sing | 1.38Å | 1.38Å | Aromatic |
| CBB | CBF | sing | 1.52Å | 1.52Å | |
| CBF | CAR | sing | 1.51Å | 1.51Å | |
| CBF | CAX | sing | 1.54Å | 1.54Å | |
| CAR | CAQ | sing | 1.52Å | 1.52Å | |
| CAQ | NAA | sing | 1.45Å | 1.45Å | |
| CAX | OAC | doub | 1.24Å | 1.24Å | |
| CAX | NAT | sing | 1.34Å | 1.34Å | |
| NAT | CAZ | sing | 1.36Å | 1.36Å | |
| CAZ | CAP | sing | 1.44Å | 1.44Å | Aromatic |
| CAZ | CAM | doub | 1.37Å | 1.37Å | Aromatic |
| CAP | CBE | doub | 1.43Å | 1.43Å | Aromatic |
| CBE | CBD | sing | 1.39Å | 1.39Å | Aromatic |
| CBE | CBC | sing | 1.42Å | 1.42Å | Aromatic |
| CAM | CAN | sing | 1.39Å | 1.39Å | Aromatic |
| CAN | CBD | doub | 1.39Å | 1.39Å | Aromatic |
| CBD | NAV | sing | 1.34Å | 1.34Å | Aromatic |
| NAV | NAS | sing | 1.24Å | 1.24Å | Aromatic |
| NAS | CBC | doub | 1.32Å | 1.32Å | Aromatic |
| CBC | NAU | sing | 1.33Å | 1.33Å | |
| NAU | CAW | sing | 1.33Å | 1.33Å | |
| CAW | OAB | doub | 1.22Å | 1.22Å | |
| CAW | CBA | sing | 1.56Å | 1.56Å | |
| CBA | CAJ | sing | 1.40Å | 1.40Å | Aromatic |
| CBA | CAK | doub | 1.38Å | 1.38Å | Aromatic |
| CAJ | CAF | doub | 1.40Å | 1.40Å | Aromatic |
| CAF | CAE | sing | 1.40Å | 1.40Å | Aromatic |
| CAE | CAG | doub | 1.38Å | 1.38Å | Aromatic |
| CAG | CAK | sing | 1.39Å | 1.39Å | Aromatic |
| CAO | HAO | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| CBF | HBF | sing | 1.10Å | 1.10Å | |
| CAR | HAR1 | sing | 1.10Å | 1.10Å | |
| CAR | HAR2 | sing | 1.10Å | 1.10Å | |
| CAQ | HAQ1 | sing | 1.10Å | 1.10Å | |
| CAQ | HAQ2 | sing | 1.10Å | 1.10Å | |
| NAA | HAA1 | sing | 1.00Å | 1.00Å | |
| NAA | HAA2 | sing | 1.00Å | 1.00Å | |
| NAT | HAT | sing | 1.00Å | 1.00Å | |
| CAP | HAP | sing | 1.08Å | 1.08Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å | |
| NAV | HAV | sing | 1.00Å | 1.00Å | |
| NAU | HAU | sing | 1.00Å | 1.00Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAY | CAO | CBB | 115.4° | 115.4° |
| CAO | CAY | CL1 | 124.2° | 124.2° |
| CAO | CAY | CAI | 122.7° | 122.7° |
| CAY | CAO | HAO | 122.3° | 122.3° |
| CAO | CBB | CAL | 121.4° | 121.4° |
| CAO | CBB | CBF | 125.5° | 125.5° |
| CBB | CAO | HAO | 122.3° | 122.3° |
| CL1 | CAY | CAI | 113.1° | 113.1° |
| CAY | CAI | CAH | 120.9° | 120.9° |
| CAY | CAI | HAI | 119.5° | 119.5° |
| CAI | CAH | CAL | 117.4° | 117.4° |
| CAH | CAI | HAI | 119.5° | 119.5° |
| CAI | CAH | HAH | 121.3° | 121.3° |
| CAH | CAL | CBB | 122.2° | 122.2° |
| CAL | CAH | HAH | 121.3° | 121.3° |
| CAH | CAL | HAL | 118.9° | 118.9° |
| CAL | CBB | CBF | 113.1° | 113.1° |
| CBB | CAL | HAL | 118.9° | 118.9° |
| CBB | CBF | CAR | 110.9° | 110.9° |
| CBB | CBF | CAX | 111.0° | 111.0° |
| CBB | CBF | HBF | 113.2° | 113.2° |
| CAR | CBF | CAX | 121.5° | 121.5° |
| CBF | CAR | CAQ | 99.5° | 99.5° |
| CAR | CBF | HBF | 99.6° | 99.6° |
| CBF | CAR | HAR1 | 112.9° | 112.9° |
| CBF | CAR | HAR2 | 115.0° | 115.0° |
| CBF | CAX | OAC | 116.4° | 116.4° |
| CBF | CAX | NAT | 121.0° | 121.0° |
| CAX | CBF | HBF | 99.5° | 99.5° |
| CAR | CAQ | NAA | 112.8° | 112.8° |
| CAQ | CAR | HAR1 | 112.9° | 112.9° |
| CAQ | CAR | HAR2 | 115.0° | 115.0° |
| CAR | CAQ | HAQ1 | 108.4° | 108.4° |
| CAR | CAQ | HAQ2 | 107.7° | 107.7° |
| NAA | CAQ | HAQ1 | 108.4° | 108.4° |
| NAA | CAQ | HAQ2 | 107.6° | 107.6° |
| CAQ | NAA | HAA1 | 109.5° | 109.5° |
| CAQ | NAA | HAA2 | 109.5° | 109.5° |
| OAC | CAX | NAT | 122.4° | 122.4° |
| CAX | NAT | CAZ | 118.1° | 118.1° |
| CAX | NAT | HAT | 121.0° | 120.9° |
| NAT | CAZ | CAP | 126.6° | 126.6° |
| NAT | CAZ | CAM | 116.0° | 116.0° |
| CAZ | NAT | HAT | 120.9° | 120.9° |
| CAP | CAZ | CAM | 117.4° | 117.4° |
| CAZ | CAP | CBE | 122.8° | 122.8° |
| CAZ | CAP | HAP | 118.6° | 118.6° |
| CAZ | CAM | CAN | 119.4° | 119.4° |
| CAZ | CAM | HAM | 120.3° | 120.3° |
| CAP | CBE | CBD | 117.1° | 117.1° |
| CAP | CBE | CBC | 141.4° | 141.4° |
| CBE | CAP | HAP | 118.6° | 118.6° |
| CBD | CBE | CBC | 101.5° | 101.5° |
| CBE | CBD | CAN | 119.3° | 119.3° |
| CBE | CBD | NAV | 109.2° | 109.2° |
| CBE | CBC | NAS | 108.3° | 108.3° |
| CBE | CBC | NAU | 132.2° | 132.2° |
| CAM | CAN | CBD | 123.9° | 123.9° |
| CAN | CAM | HAM | 120.3° | 120.3° |
| CAM | CAN | HAN | 118.0° | 118.0° |
| CAN | CBD | NAV | 131.5° | 131.5° |
| CBD | CAN | HAN | 118.0° | 118.0° |
| CBD | NAV | NAS | 109.7° | 109.7° |
| CBD | NAV | HAV | 125.2° | 125.2° |
| NAV | NAS | CBC | 111.3° | 111.3° |
| NAS | NAV | HAV | 125.2° | 125.2° |
| NAS | CBC | NAU | 119.2° | 119.2° |
| CBC | NAU | CAW | 123.8° | 123.8° |
| CBC | NAU | HAU | 118.1° | 118.1° |
| NAU | CAW | OAB | 122.5° | 122.5° |
| NAU | CAW | CBA | 118.7° | 118.7° |
| CAW | NAU | HAU | 118.1° | 118.1° |
| OAB | CAW | CBA | 118.8° | 118.8° |
| CAW | CBA | CAJ | 120.4° | 120.4° |
| CAW | CBA | CAK | 122.2° | 122.2° |
| CAJ | CBA | CAK | 117.4° | 117.4° |
| CBA | CAJ | CAF | 121.4° | 121.4° |
| CBA | CAJ | HAJ | 119.3° | 119.3° |
| CBA | CAK | CAG | 120.9° | 120.9° |
| CBA | CAK | HAK | 119.5° | 119.5° |
| CAJ | CAF | CAE | 121.0° | 121.0° |
| CAF | CAJ | HAJ | 119.3° | 119.3° |
| CAJ | CAF | HAF | 119.5° | 119.5° |
| CAF | CAE | CAG | 116.7° | 116.7° |
| CAE | CAF | HAF | 119.5° | 119.5° |
| CAF | CAE | HAE | 121.6° | 121.6° |
| CAE | CAG | CAK | 122.5° | 122.5° |
| CAG | CAE | HAE | 121.6° | 121.6° |
| CAE | CAG | HAG | 118.7° | 118.7° |
| CAG | CAK | HAK | 119.6° | 119.6° |
| CAK | CAG | HAG | 118.7° | 118.7° |
| HAR1 | CAR | HAR2 | 102.1° | 102.1° |
| HAQ1 | CAQ | HAQ2 | 112.1° | 112.1° |
| HAA1 | NAA | HAA2 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAY | CAO | CBB | HAO | 180.0° | 180.0° |
| CAO | CAY | CL1 | CAI | 179.6° | 179.6° |
| CAO | CAY | CAI | CAH | 0.3° | 0.3° |
| CAY | CAO | CBB | CAL | 1.4° | 1.4° |
| CAY | CAO | CBB | CBF | 179.4° | 179.4° |
| CAO | CAY | CAI | HAI | 179.7° | 179.7° |
| CBB | CAO | CAY | CL1 | 179.8° | 179.8° |
| CBB | CAO | CAY | CAI | 0.6° | 0.6° |
| CAO | CBB | CAL | CAH | 1.5° | 1.5° |
| CAO | CBB | CAL | CBF | 179.2° | 179.2° |
| CAO | CBB | CBF | CAR | 41.7° | 41.7° |
| CAO | CBB | CBF | CAX | 96.4° | 96.4° |
| CAO | CBB | CAL | HAL | 178.5° | 178.5° |
| CAO | CBB | CBF | HBF | 152.7° | 152.7° |
| CL1 | CAY | CAI | CAH | 179.3° | 179.3° |
| CL1 | CAY | CAO | HAO | 0.2° | 0.2° |
| CL1 | CAY | CAI | HAI | 0.6° | 0.6° |
| CAY | CAI | CAH | HAI | 180.0° | 180.0° |
| CAY | CAI | CAH | CAL | 0.4° | 0.4° |
| CAI | CAY | CAO | HAO | 179.4° | 179.4° |
| CAY | CAI | CAH | HAH | 179.6° | 179.6° |
| CAI | CAH | CAL | HAH | 180.0° | 180.0° |
| CAI | CAH | CAL | CBB | 0.5° | 0.5° |
| CAI | CAH | CAL | HAL | 179.5° | 179.5° |
| CAH | CAL | CBB | HAL | 180.0° | 180.0° |
| CAH | CAL | CBB | CBF | 179.3° | 179.3° |
| CAL | CAH | CAI | HAI | 179.6° | 179.6° |
| CAL | CBB | CBF | CAR | 137.5° | 137.5° |
| CAL | CBB | CBF | CAX | 84.4° | 84.4° |
| CAL | CBB | CAO | HAO | 178.5° | 178.5° |
| CBB | CAL | CAH | HAH | 179.5° | 179.5° |
| CAL | CBB | CBF | HBF | 26.5° | 26.5° |
| CBB | CBF | CAR | CAX | 133.1° | 133.1° |
| CBB | CBF | CAR | HBF | 119.5° | 119.5° |
| CBB | CBF | CAX | HBF | 119.4° | 119.4° |
| CBB | CBF | CAR | CAQ | 77.2° | 77.2° |
| CBB | CBF | CAX | OAC | 102.7° | 102.7° |
| CBB | CBF | CAX | NAT | 71.7° | 71.7° |
| CBF | CBB | CAO | HAO | 0.6° | 0.6° |
| CBF | CBB | CAL | HAL | 0.7° | 0.7° |
| CBB | CBF | CAR | HAR1 | 162.8° | 162.8° |
| CBB | CBF | CAR | HAR2 | 46.2° | 46.2° |
| CAR | CBF | CAX | HBF | 107.5° | 107.5° |
| CBF | CAR | CAQ | HAR1 | 120.0° | 120.0° |
| CBF | CAR | CAQ | HAR2 | 123.4° | 123.4° |
| CBF | CAR | CAQ | NAA | 174.7° | 174.7° |
| CAR | CBF | CAX | OAC | 124.3° | 124.3° |
| CAR | CBF | CAX | NAT | 61.3° | 61.3° |
| CBF | CAR | HAR1 | HAR2 | 124.0° | 124.0° |
| CBF | CAR | CAQ | HAQ1 | 54.7° | 54.7° |
| CBF | CAR | CAQ | HAQ2 | 66.7° | 66.7° |
| CAX | CBF | CAR | CAQ | 149.7° | 149.7° |
| CBF | CAX | OAC | NAT | 174.3° | 174.3° |
| CBF | CAX | NAT | CAZ | 174.8° | 174.8° |
| CAX | CBF | CAR | HAR1 | 29.7° | 29.7° |
| CAX | CBF | CAR | HAR2 | 86.9° | 86.9° |
| CBF | CAX | NAT | HAT | 5.3° | 5.2° |
| CAR | CAQ | NAA | HAQ1 | 120.0° | 120.0° |
| CAR | CAQ | NAA | HAQ2 | 118.6° | 118.6° |
| CAQ | CAR | CBF | HBF | 42.3° | 42.3° |
| CAQ | CAR | HAR1 | HAR2 | 124.0° | 124.0° |
| CAR | CAQ | HAQ1 | HAQ2 | 118.7° | 118.7° |
| CAR | CAQ | NAA | HAA1 | 1.6° | 1.6° |
| CAR | CAQ | NAA | HAA2 | 121.5° | 121.5° |
| NAA | CAQ | CAR | HAR1 | 65.3° | 65.3° |
| NAA | CAQ | CAR | HAR2 | 51.3° | 51.3° |
| NAA | CAQ | HAQ1 | HAQ2 | 118.6° | 118.6° |
| CAQ | NAA | HAA1 | HAA2 | 120.0° | 120.0° |
| OAC | CAX | NAT | CAZ | 0.7° | 0.7° |
| OAC | CAX | CBF | HBF | 16.7° | 16.7° |
| OAC | CAX | NAT | HAT | 179.3° | 179.3° |
| CAX | NAT | CAZ | HAT | 180.0° | 180.0° |
| CAX | NAT | CAZ | CAP | 19.9° | 19.9° |
| CAX | NAT | CAZ | CAM | 161.9° | 161.9° |
| NAT | CAX | CBF | HBF | 168.9° | 168.9° |
| NAT | CAZ | CAP | CAM | 178.2° | 178.2° |
| NAT | CAZ | CAP | CBE | 179.5° | 179.5° |
| NAT | CAZ | CAM | CAN | 179.1° | 179.1° |
| NAT | CAZ | CAP | HAP | 0.5° | 0.5° |
| NAT | CAZ | CAM | HAM | 0.9° | 0.9° |
| CAZ | CAP | CBE | HAP | 180.0° | 180.0° |
| CAZ | CAP | CBE | CBD | 0.8° | 0.8° |
| CAZ | CAP | CBE | CBC | 178.6° | 178.6° |
| CAP | CAZ | CAM | CAN | 0.7° | 0.7° |
| CAP | CAZ | NAT | HAT | 160.1° | 160.1° |
| CAP | CAZ | CAM | HAM | 179.3° | 179.3° |
| CAM | CAZ | CAP | CBE | 1.3° | 1.3° |
| CAZ | CAM | CAN | HAM | 180.0° | 180.0° |
| CAZ | CAM | CAN | CBD | 0.3° | 0.3° |
| CAM | CAZ | NAT | HAT | 18.1° | 18.1° |
| CAM | CAZ | CAP | HAP | 178.7° | 178.7° |
| CAZ | CAM | CAN | HAN | 179.6° | 179.6° |
| CAP | CBE | CBD | CBC | 178.6° | 178.6° |
| CAP | CBE | CBD | CAN | 0.2° | 0.2° |
| CAP | CBE | CBD | NAV | 179.7° | 179.7° |
| CAP | CBE | CBC | NAS | 180.0° | 180.0° |
| CAP | CBE | CBC | NAU | 6.1° | 6.1° |
| CBE | CBD | CAN | CAM | 0.8° | 0.8° |
| CBE | CBD | CAN | NAV | 179.9° | 179.9° |
| CBE | CBD | NAV | NAS | 0.8° | 0.8° |
| CBD | CBE | CBC | NAS | 2.0° | 2.0° |
| CBD | CBE | CBC | NAU | 176.0° | 176.0° |
| CBD | CBE | CAP | HAP | 179.2° | 179.2° |
| CBE | CBD | CAN | HAN | 179.1° | 179.1° |
| CBE | CBD | NAV | HAV | 179.2° | 179.2° |
| CBC | CBE | CBD | CAN | 178.3° | 178.3° |
| CBC | CBE | CBD | NAV | 1.7° | 1.7° |
| CBE | CBC | NAS | NAV | 1.7° | 1.7° |
| CBE | CBC | NAS | NAU | 174.9° | 174.9° |
| CBE | CBC | NAU | CAW | 28.8° | 28.8° |
| CBC | CBE | CAP | HAP | 1.4° | 1.4° |
| CBE | CBC | NAU | HAU | 151.2° | 151.2° |
| CAM | CAN | CBD | HAN | 180.0° | 180.0° |
| CAM | CAN | CBD | NAV | 179.1° | 179.1° |
| CAN | CBD | NAV | NAS | 179.3° | 179.3° |
| CBD | CAN | CAM | HAM | 179.6° | 179.6° |
| CAN | CBD | NAV | HAV | 0.7° | 0.7° |
| CBD | NAV | NAS | HAV | 180.0° | 180.0° |
| CBD | NAV | NAS | CBC | 0.6° | 0.6° |
| NAV | CBD | CAN | HAN | 0.9° | 0.9° |
| NAV | NAS | CBC | NAU | 176.6° | 176.6° |
| NAS | CBC | NAU | CAW | 157.8° | 157.8° |
| CBC | NAS | NAV | HAV | 179.4° | 179.4° |
| NAS | CBC | NAU | HAU | 22.2° | 22.2° |
| CBC | NAU | CAW | HAU | 180.0° | 180.0° |
| CBC | NAU | CAW | OAB | 8.1° | 8.1° |
| CBC | NAU | CAW | CBA | 172.8° | 172.8° |
| NAU | CAW | OAB | CBA | 179.1° | 179.1° |
| NAU | CAW | CBA | CAJ | 173.9° | 173.9° |
| NAU | CAW | CBA | CAK | 6.7° | 6.7° |
| OAB | CAW | CBA | CAJ | 5.2° | 5.2° |
| OAB | CAW | CBA | CAK | 174.1° | 174.1° |
| OAB | CAW | NAU | HAU | 171.9° | 171.9° |
| CAW | CBA | CAJ | CAK | 179.3° | 179.3° |
| CAW | CBA | CAJ | CAF | 179.7° | 179.7° |
| CAW | CBA | CAK | CAG | 179.8° | 179.8° |
| CBA | CAW | NAU | HAU | 7.2° | 7.2° |
| CAW | CBA | CAJ | HAJ | 0.3° | 0.3° |
| CAW | CBA | CAK | HAK | 0.2° | 0.2° |
| CBA | CAJ | CAF | HAJ | 180.0° | 180.0° |
| CBA | CAJ | CAF | CAE | 0.3° | 0.3° |
| CAJ | CBA | CAK | CAG | 0.9° | 0.9° |
| CAJ | CBA | CAK | HAK | 179.1° | 179.2° |
| CBA | CAJ | CAF | HAF | 179.7° | 179.7° |
| CAK | CBA | CAJ | CAF | 0.3° | 0.3° |
| CBA | CAK | CAG | CAE | 1.5° | 1.5° |
| CBA | CAK | CAG | HAK | 180.0° | 180.0° |
| CAK | CBA | CAJ | HAJ | 179.7° | 179.7° |
| CBA | CAK | CAG | HAG | 178.5° | 178.5° |
| CAJ | CAF | CAE | HAF | 180.0° | 180.0° |
| CAJ | CAF | CAE | CAG | 0.8° | 0.8° |
| CAJ | CAF | CAE | HAE | 179.2° | 179.2° |
| CAF | CAE | CAG | HAE | 180.0° | 180.0° |
| CAF | CAE | CAG | CAK | 1.4° | 1.4° |
| CAE | CAF | CAJ | HAJ | 179.7° | 179.7° |
| CAF | CAE | CAG | HAG | 178.6° | 178.6° |
| CAE | CAG | CAK | HAG | 180.0° | 180.0° |
| CAE | CAG | CAK | HAK | 178.5° | 178.6° |
| CAG | CAE | CAF | HAF | 179.1° | 179.1° |
| CAK | CAG | CAE | HAE | 178.6° | 178.6° |
| HAI | CAI | CAH | HAH | 0.4° | 0.4° |
| HAH | CAH | CAL | HAL | 0.5° | 0.5° |
| HBF | CBF | CAR | HAR1 | 77.8° | 77.8° |
| HBF | CBF | CAR | HAR2 | 165.7° | 165.7° |
| HAR1 | CAR | CAQ | HAQ1 | 174.7° | 174.7° |
| HAR1 | CAR | CAQ | HAQ2 | 53.3° | 53.3° |
| HAR2 | CAR | CAQ | HAQ1 | 68.7° | 68.7° |
| HAR2 | CAR | CAQ | HAQ2 | 169.8° | 169.8° |
| HAQ1 | CAQ | NAA | HAA1 | 118.4° | 118.4° |
| HAQ1 | CAQ | NAA | HAA2 | 1.5° | 1.5° |
| HAQ2 | CAQ | NAA | HAA1 | 120.1° | 120.2° |
| HAQ2 | CAQ | NAA | HAA2 | 119.9° | 119.9° |
| HAM | CAM | CAN | HAN | 0.4° | 0.4° |
| HAJ | CAJ | CAF | HAF | 0.4° | 0.4° |
| HAK | CAK | CAG | HAG | 1.5° | 1.4° |
| HAF | CAF | CAE | HAE | 0.8° | 0.8° |
| HAE | CAE | CAG | HAG | 1.4° | 1.4° |
