RXC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAE | CAX | doub | 1.22Å | 1.28Å | |
| CAX | NAP | sing | 1.34Å | 1.38Å | |
| CAX | CAZ | sing | 1.48Å | 1.39Å | |
| NAP | CAW | sing | 1.34Å | 1.36Å | |
| CAW | OAD | doub | 1.21Å | 1.26Å | |
| CAW | CAY | sing | 1.50Å | 1.39Å | |
| CAZ | CBA | doub | 1.41Å | 1.42Å | Aromatic |
| CAZ | CAM | sing | 1.39Å | 1.42Å | Aromatic |
| CBA | CAY | sing | 1.47Å | 1.41Å | |
| CBA | CAV | sing | 1.40Å | 1.38Å | Aromatic |
| CAY | OAF | doub | 1.21Å | 1.29Å | |
| CAM | CAI | doub | 1.39Å | 1.40Å | Aromatic |
| CAI | CAL | sing | 1.38Å | 1.42Å | Aromatic |
| CAL | CAV | doub | 1.39Å | 1.41Å | Aromatic |
| CAV | NAO | sing | 1.39Å | 1.38Å | |
| NAO | CAS | sing | 1.35Å | 1.34Å | |
| CAS | OAC | doub | 1.21Å | 1.24Å | |
| CAS | CBB | sing | 1.51Å | 1.50Å | |
| CBB | OAQ | sing | 1.45Å | 1.44Å | |
| CBB | CAU | sing | 1.51Å | 1.49Å | |
| OAQ | CAR | sing | 1.34Å | 1.46Å | |
| CAR | OAB | doub | 1.21Å | 1.24Å | |
| CAR | CAA | sing | 1.51Å | 1.52Å | |
| CAU | CAK | doub | 1.38Å | 1.40Å | Aromatic |
| CAU | CAN | sing | 1.38Å | 1.41Å | Aromatic |
| CAK | CAH | sing | 1.38Å | 1.41Å | Aromatic |
| CAH | CAJ | doub | 1.38Å | 1.41Å | Aromatic |
| CAJ | CAT | sing | 1.38Å | 1.39Å | Aromatic |
| CAT | CLAG | sing | 1.74Å | 1.82Å | |
| CAT | CAN | doub | 1.38Å | 1.40Å | Aromatic |
| NAP | HNAP | sing | 0.97Å | 1.00Å | |
| CAM | HAM | sing | 1.08Å | 1.08Å | |
| CAI | HAI | sing | 1.08Å | 1.08Å | |
| CAL | HAL | sing | 1.08Å | 1.08Å | |
| NAO | HNAO | sing | 0.97Å | 1.00Å | |
| CBB | HBB | sing | 1.09Å | 1.10Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| CAK | HAK | sing | 1.08Å | 1.08Å | |
| CAH | HAH | sing | 1.08Å | 1.08Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAN | HAN | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAE | CAX | NAP | 122.4° | 119.3° |
| OAE | CAX | CAZ | 118.8° | 119.3° |
| NAP | CAX | CAZ | 118.8° | 121.4° |
| CAX | NAP | CAW | 124.0° | 122.8° |
| CAX | NAP | HNAP | 118.0° | 118.6° |
| CAX | CAZ | CBA | 117.7° | 119.3° |
| CAX | CAZ | CAM | 119.5° | 121.2° |
| NAP | CAW | OAD | 121.6° | 119.8° |
| NAP | CAW | CAY | 119.8° | 120.4° |
| CAW | NAP | HNAP | 118.0° | 118.6° |
| OAD | CAW | CAY | 118.5° | 119.8° |
| CAW | CAY | CBA | 117.2° | 117.9° |
| CAW | CAY | OAF | 119.8° | 121.1° |
| CBA | CAZ | CAM | 122.8° | 119.5° |
| CAZ | CBA | CAY | 122.6° | 118.3° |
| CAZ | CBA | CAV | 119.7° | 120.0° |
| CAZ | CAM | CAI | 117.0° | 119.9° |
| CAZ | CAM | HAM | 121.5° | 120.0° |
| CAY | CBA | CAV | 117.8° | 121.7° |
| CBA | CAY | OAF | 123.0° | 121.0° |
| CBA | CAV | CAL | 118.4° | 119.3° |
| CBA | CAV | NAO | 115.7° | 120.3° |
| CAM | CAI | CAL | 119.8° | 120.9° |
| CAI | CAM | HAM | 121.5° | 120.1° |
| CAM | CAI | HAI | 120.1° | 119.5° |
| CAI | CAL | CAV | 122.3° | 120.3° |
| CAL | CAI | HAI | 120.1° | 119.6° |
| CAI | CAL | HAL | 118.9° | 119.8° |
| CAL | CAV | NAO | 125.8° | 120.3° |
| CAV | CAL | HAL | 118.9° | 119.8° |
| CAV | NAO | CAS | 124.9° | 120.0° |
| CAV | NAO | HNAO | 117.5° | 120.0° |
| NAO | CAS | OAC | 125.1° | 120.0° |
| NAO | CAS | CBB | 117.1° | 120.0° |
| CAS | NAO | HNAO | 117.6° | 120.0° |
| OAC | CAS | CBB | 117.5° | 120.0° |
| CAS | CBB | OAQ | 109.9° | 109.5° |
| CAS | CBB | CAU | 117.6° | 109.5° |
| CAS | CBB | HBB | 103.0° | 109.5° |
| OAQ | CBB | CAU | 108.2° | 109.5° |
| CBB | OAQ | CAR | 110.1° | 117.0° |
| OAQ | CBB | HBB | 113.3° | 109.4° |
| CBB | CAU | CAK | 121.3° | 120.0° |
| CBB | CAU | CAN | 118.2° | 120.0° |
| CAU | CBB | HBB | 104.8° | 109.5° |
| OAQ | CAR | OAB | 116.6° | 120.0° |
| OAQ | CAR | CAA | 119.4° | 119.9° |
| OAB | CAR | CAA | 124.0° | 120.0° |
| CAR | CAA | HAA | 109.5° | 109.5° |
| CAR | CAA | HAAA | 109.5° | 109.5° |
| CAR | CAA | HAAB | 109.5° | 109.5° |
| CAK | CAU | CAN | 120.3° | 120.0° |
| CAU | CAK | CAH | 117.7° | 120.0° |
| CAU | CAK | HAK | 121.1° | 120.0° |
| CAU | CAN | CAT | 121.5° | 120.0° |
| CAU | CAN | HAN | 119.2° | 120.1° |
| CAK | CAH | CAJ | 121.7° | 120.0° |
| CAH | CAK | HAK | 121.2° | 120.0° |
| CAK | CAH | HAH | 119.1° | 120.0° |
| CAH | CAJ | CAT | 119.8° | 120.0° |
| CAJ | CAH | HAH | 119.2° | 120.0° |
| CAH | CAJ | HAJ | 120.1° | 120.0° |
| CAJ | CAT | CLAG | 121.7° | 120.0° |
| CAJ | CAT | CAN | 118.9° | 119.9° |
| CAT | CAJ | HAJ | 120.1° | 120.0° |
| CLAG | CAT | CAN | 119.4° | 120.1° |
| CAT | CAN | HAN | 119.2° | 119.9° |
| HAA | CAA | HAAA | 109.5° | 109.4° |
| HAA | CAA | HAAB | 109.4° | 109.5° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAE | CAX | NAP | CAZ | 179.8° | 179.7° |
| OAE | CAX | NAP | CAW | 179.6° | 180.0° |
| OAE | CAX | CAZ | CBA | 179.7° | 180.0° |
| OAE | CAX | CAZ | CAM | 0.5° | 0.0° |
| OAE | CAX | NAP | HNAP | 0.4° | 0.0° |
| CAX | NAP | CAW | HNAP | 180.0° | 180.0° |
| CAX | NAP | CAW | OAD | 179.6° | 180.0° |
| CAX | NAP | CAW | CAY | 0.0° | 0.0° |
| NAP | CAX | CAZ | CBA | 0.1° | 0.2° |
| NAP | CAX | CAZ | CAM | 179.7° | 179.7° |
| CAZ | CAX | NAP | CAW | 0.2° | 0.2° |
| CAX | CAZ | CBA | CAM | 179.9° | 179.9° |
| CAX | CAZ | CBA | CAY | 0.1° | 0.0° |
| CAX | CAZ | CBA | CAV | 179.3° | 180.0° |
| CAX | CAZ | CAM | CAI | 179.9° | 180.0° |
| CAZ | CAX | NAP | HNAP | 179.8° | 179.7° |
| CAX | CAZ | CAM | HAM | 0.1° | 0.1° |
| NAP | CAW | OAD | CAY | 179.7° | 180.0° |
| NAP | CAW | CAY | CBA | 0.2° | 0.2° |
| NAP | CAW | CAY | OAF | 179.8° | 180.0° |
| OAD | CAW | CAY | CBA | 179.5° | 179.8° |
| OAD | CAW | CAY | OAF | 0.1° | 0.0° |
| OAD | CAW | NAP | HNAP | 0.3° | 0.0° |
| CAW | CAY | CBA | CAZ | 0.2° | 0.2° |
| CAW | CAY | CBA | OAF | 179.5° | 179.8° |
| CAW | CAY | CBA | CAV | 179.1° | 179.8° |
| CAY | CAW | NAP | HNAP | 180.0° | 180.0° |
| CAZ | CBA | CAY | CAV | 179.3° | 180.0° |
| CAZ | CBA | CAY | OAF | 179.8° | 180.0° |
| CBA | CAZ | CAM | CAI | 0.0° | 0.0° |
| CAZ | CBA | CAV | CAL | 0.4° | 0.1° |
| CAZ | CBA | CAV | NAO | 179.9° | 179.9° |
| CBA | CAZ | CAM | HAM | 180.0° | 180.0° |
| CAM | CAZ | CBA | CAY | 179.9° | 179.9° |
| CAM | CAZ | CBA | CAV | 0.6° | 0.1° |
| CAZ | CAM | CAI | HAM | 180.0° | 180.0° |
| CAZ | CAM | CAI | CAL | 0.7° | 0.0° |
| CAZ | CAM | CAI | HAI | 179.3° | 180.0° |
| CAY | CBA | CAV | CAL | 179.8° | 179.9° |
| CAY | CBA | CAV | NAO | 0.5° | 0.1° |
| CAV | CBA | CAY | OAF | 0.4° | 0.0° |
| CBA | CAV | CAL | CAI | 0.3° | 0.0° |
| CBA | CAV | CAL | NAO | 179.6° | 180.0° |
| CBA | CAV | NAO | CAS | 176.0° | 144.9° |
| CBA | CAV | CAL | HAL | 179.7° | 179.9° |
| CBA | CAV | NAO | HNAO | 4.0° | 35.0° |
| CAM | CAI | CAL | HAI | 180.0° | 180.0° |
| CAM | CAI | CAL | CAV | 0.9° | 0.0° |
| CAM | CAI | CAL | HAL | 179.1° | 180.0° |
| CAI | CAL | CAV | HAL | 180.0° | 180.0° |
| CAI | CAL | CAV | NAO | 179.3° | 180.0° |
| CAL | CAI | CAM | HAM | 179.3° | 179.9° |
| CAL | CAV | NAO | CAS | 3.6° | 35.1° |
| CAV | CAL | CAI | HAI | 179.1° | 180.0° |
| CAL | CAV | NAO | HNAO | 176.4° | 145.0° |
| CAV | NAO | CAS | HNAO | 180.0° | 179.9° |
| CAV | NAO | CAS | OAC | 2.2° | 4.7° |
| CAV | NAO | CAS | CBB | 174.7° | 175.4° |
| NAO | CAV | CAL | HAL | 0.7° | 0.1° |
| NAO | CAS | OAC | CBB | 172.5° | 180.0° |
| NAO | CAS | CBB | OAQ | 142.8° | 175.0° |
| NAO | CAS | CBB | CAU | 18.4° | 65.0° |
| NAO | CAS | CBB | HBB | 96.2° | 55.1° |
| OAC | CAS | CBB | OAQ | 44.1° | 5.0° |
| OAC | CAS | CBB | CAU | 168.5° | 115.0° |
| OAC | CAS | NAO | HNAO | 177.8° | 175.4° |
| OAC | CAS | CBB | HBB | 76.9° | 125.0° |
| CAS | CBB | OAQ | CAU | 129.6° | 120.0° |
| CAS | CBB | OAQ | HBB | 114.6° | 120.0° |
| CAS | CBB | CAU | HBB | 113.6° | 120.0° |
| CAS | CBB | OAQ | CAR | 87.7° | 90.0° |
| CAS | CBB | CAU | CAK | 78.8° | 100.0° |
| CAS | CBB | CAU | CAN | 105.9° | 80.3° |
| CBB | CAS | NAO | HNAO | 5.3° | 4.6° |
| OAQ | CBB | CAU | HBB | 121.2° | 120.0° |
| CBB | OAQ | CAR | OAB | 163.5° | 0.0° |
| CBB | OAQ | CAR | CAA | 16.3° | 180.0° |
| OAQ | CBB | CAU | CAK | 46.5° | 140.0° |
| OAQ | CBB | CAU | CAN | 128.9° | 39.7° |
| CAU | CBB | OAQ | CAR | 142.7° | 150.0° |
| CBB | CAU | CAK | CAN | 175.2° | 179.7° |
| CBB | CAU | CAK | CAH | 177.2° | 180.0° |
| CBB | CAU | CAN | CAT | 177.2° | 179.8° |
| CBB | CAU | CAK | HAK | 2.8° | 0.0° |
| CBB | CAU | CAN | HAN | 2.8° | 0.0° |
| OAQ | CAR | OAB | CAA | 179.8° | 180.0° |
| CAR | OAQ | CBB | HBB | 26.9° | 30.0° |
| OAQ | CAR | CAA | HAA | 179.6° | 90.0° |
| OAQ | CAR | CAA | HAAA | 60.5° | 150.0° |
| OAQ | CAR | CAA | HAAB | 59.6° | 30.0° |
| OAB | CAR | CAA | HAA | 0.3° | 89.9° |
| OAB | CAR | CAA | HAAA | 119.7° | 30.0° |
| OAB | CAR | CAA | HAAB | 120.2° | 150.0° |
| CAR | CAA | HAA | HAAA | 120.0° | 120.0° |
| CAR | CAA | HAA | HAAB | 120.0° | 120.0° |
| CAR | CAA | HAAA | HAAB | 120.0° | 120.0° |
| CAU | CAK | CAH | HAK | 180.0° | 179.9° |
| CAU | CAK | CAH | CAJ | 1.0° | 0.1° |
| CAK | CAU | CAN | CAT | 1.8° | 0.5° |
| CAK | CAU | CBB | HBB | 167.7° | 20.0° |
| CAU | CAK | CAH | HAH | 179.0° | 180.0° |
| CAK | CAU | CAN | HAN | 178.2° | 179.7° |
| CAN | CAU | CAK | CAH | 2.0° | 0.3° |
| CAU | CAN | CAT | CAJ | 0.6° | 0.5° |
| CAU | CAN | CAT | CLAG | 179.0° | 179.7° |
| CAU | CAN | CAT | HAN | 180.0° | 179.8° |
| CAN | CAU | CBB | HBB | 7.7° | 159.7° |
| CAN | CAU | CAK | HAK | 178.0° | 179.7° |
| CAK | CAH | CAJ | HAH | 180.0° | 180.0° |
| CAK | CAH | CAJ | CAT | 0.2° | 0.0° |
| CAK | CAH | CAJ | HAJ | 179.8° | 180.0° |
| CAH | CAJ | CAT | HAJ | 180.0° | 180.0° |
| CAH | CAJ | CAT | CLAG | 180.0° | 180.0° |
| CAH | CAJ | CAT | CAN | 0.4° | 0.2° |
| CAJ | CAH | CAK | HAK | 179.0° | 180.0° |
| CAJ | CAT | CLAG | CAN | 179.5° | 179.8° |
| CAT | CAJ | CAH | HAH | 179.8° | 180.0° |
| CAJ | CAT | CAN | HAN | 179.4° | 179.8° |
| CLAG | CAT | CAJ | HAJ | 0.0° | 0.0° |
| CLAG | CAT | CAN | HAN | 1.0° | 0.0° |
| CAN | CAT | CAJ | HAJ | 179.6° | 179.8° |
| HAM | CAM | CAI | HAI | 0.7° | 0.0° |
| HAI | CAI | CAL | HAL | 0.9° | 0.0° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.0° |
| HAK | CAK | CAH | HAH | 1.0° | 0.0° |
| HAH | CAH | CAJ | HAJ | 0.2° | 0.0° |
