15Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAC | CAD | doub | 1.37Å | 1.39Å | Aromatic |
| CAC | CAB | sing | 1.39Å | 1.40Å | Aromatic |
| CAD | CAE | sing | 1.39Å | 1.40Å | Aromatic |
| OAR | CAB | sing | 1.36Å | 1.36Å | |
| CAB | CAA | doub | 1.38Å | 1.40Å | Aromatic |
| OAQ | CAH | doub | 1.22Å | 1.24Å | |
| CAE | CAH | sing | 1.48Å | 1.43Å | |
| CAE | CAF | doub | 1.41Å | 1.41Å | Aromatic |
| CAH | CAI | sing | 1.41Å | 1.39Å | |
| CAA | CAF | sing | 1.39Å | 1.40Å | Aromatic |
| CAF | OAG | sing | 1.35Å | 1.38Å | |
| CAI | CAJ | doub | 1.36Å | 1.40Å | |
| OAG | CAJ | sing | 1.34Å | 1.37Å | |
| CAJ | CAK | sing | 1.48Å | 1.41Å | |
| CAK | CAM | doub | 1.40Å | 1.39Å | Aromatic |
| CAK | CAN | sing | 1.40Å | 1.41Å | Aromatic |
| CAM | CAL | sing | 1.38Å | 1.40Å | Aromatic |
| CAN | CAO | doub | 1.38Å | 1.40Å | Aromatic |
| CAL | OAT | sing | 1.36Å | 1.38Å | |
| CAL | CAP | doub | 1.39Å | 1.39Å | Aromatic |
| CAO | CAP | sing | 1.39Å | 1.38Å | Aromatic |
| CAP | OAS | sing | 1.36Å | 1.36Å | |
| CAM | H1 | sing | 1.08Å | 1.08Å | |
| OAT | H2 | sing | 0.97Å | 0.95Å | |
| OAS | H3 | sing | 0.97Å | 0.95Å | |
| CAO | H4 | sing | 1.08Å | 1.08Å | |
| CAN | H5 | sing | 1.08Å | 1.08Å | |
| CAA | H6 | sing | 1.08Å | 1.08Å | |
| OAR | H7 | sing | 0.97Å | 0.95Å | |
| CAC | H8 | sing | 1.08Å | 1.08Å | |
| CAD | H9 | sing | 1.08Å | 1.08Å | |
| CAI | H10 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAD | CAC | CAB | 119.9° | 120.3° |
| CAC | CAD | CAE | 122.1° | 119.8° |
| CAD | CAC | H8 | 120.0° | 119.9° |
| CAC | CAD | H9 | 118.9° | 120.1° |
| CAC | CAB | OAR | 119.1° | 119.7° |
| CAC | CAB | CAA | 119.8° | 120.5° |
| CAB | CAC | H8 | 120.0° | 119.8° |
| CAD | CAE | CAH | 121.7° | 121.3° |
| CAD | CAE | CAF | 116.9° | 120.2° |
| CAE | CAD | H9 | 119.0° | 120.1° |
| OAR | CAB | CAA | 121.1° | 119.7° |
| CAB | OAR | H7 | 109.5° | 114.0° |
| CAB | CAA | CAF | 119.1° | 119.8° |
| CAB | CAA | H6 | 120.5° | 120.1° |
| OAQ | CAH | CAE | 122.6° | 121.3° |
| OAQ | CAH | CAI | 119.3° | 121.3° |
| CAH | CAE | CAF | 121.4° | 118.4° |
| CAE | CAH | CAI | 118.0° | 117.4° |
| CAE | CAF | CAA | 122.1° | 119.3° |
| CAE | CAF | OAG | 118.3° | 119.8° |
| CAH | CAI | CAJ | 119.4° | 119.6° |
| CAH | CAI | H10 | 120.3° | 120.3° |
| CAA | CAF | OAG | 119.5° | 120.9° |
| CAF | CAA | H6 | 120.4° | 120.1° |
| CAF | OAG | CAJ | 120.7° | 122.3° |
| CAI | CAJ | OAG | 121.8° | 122.5° |
| CAI | CAJ | CAK | 126.7° | 118.8° |
| CAJ | CAI | H10 | 120.3° | 120.2° |
| OAG | CAJ | CAK | 111.4° | 118.7° |
| CAJ | CAK | CAM | 124.0° | 120.1° |
| CAJ | CAK | CAN | 117.3° | 120.1° |
| CAM | CAK | CAN | 118.7° | 119.9° |
| CAK | CAM | CAL | 119.6° | 119.8° |
| CAK | CAM | H1 | 120.2° | 120.1° |
| CAK | CAN | CAO | 121.4° | 120.0° |
| CAK | CAN | H5 | 119.3° | 120.0° |
| CAM | CAL | OAT | 123.6° | 120.0° |
| CAM | CAL | CAP | 121.2° | 120.0° |
| CAL | CAM | H1 | 120.2° | 120.1° |
| CAN | CAO | CAP | 119.4° | 120.2° |
| CAN | CAO | H4 | 120.3° | 120.0° |
| CAO | CAN | H5 | 119.3° | 120.0° |
| OAT | CAL | CAP | 115.1° | 120.0° |
| CAL | OAT | H2 | 109.5° | 114.0° |
| CAL | CAP | CAO | 119.8° | 120.1° |
| CAL | CAP | OAS | 116.4° | 119.9° |
| CAO | CAP | OAS | 123.8° | 119.9° |
| CAP | CAO | H4 | 120.3° | 119.9° |
| CAP | OAS | H3 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAD | CAC | CAB | H8 | 180.0° | 179.9° |
| CAC | CAD | CAE | H9 | 180.0° | 179.9° |
| CAD | CAC | CAB | OAR | 179.1° | 180.0° |
| CAD | CAC | CAB | CAA | 1.5° | 0.0° |
| CAC | CAD | CAE | CAH | 178.9° | 180.0° |
| CAC | CAD | CAE | CAF | 2.3° | 0.0° |
| CAB | CAC | CAD | CAE | 0.0° | 0.0° |
| CAC | CAB | OAR | CAA | 179.3° | 180.0° |
| CAC | CAB | CAA | CAF | 0.6° | 0.0° |
| CAC | CAB | CAA | H6 | 179.4° | 180.0° |
| CAC | CAB | OAR | H7 | 180.0° | 90.0° |
| CAB | CAC | CAD | H9 | 180.0° | 180.0° |
| CAD | CAE | CAH | OAQ | 8.9° | 0.0° |
| CAD | CAE | CAH | CAF | 176.4° | 180.0° |
| CAD | CAE | CAH | CAI | 173.9° | 179.7° |
| CAD | CAE | CAF | CAA | 3.3° | 0.0° |
| CAD | CAE | CAF | OAG | 179.1° | 179.9° |
| CAE | CAD | CAC | H8 | 180.0° | 179.9° |
| OAR | CAB | CAA | CAF | 179.9° | 180.0° |
| OAR | CAB | CAA | H6 | 0.1° | 0.0° |
| OAR | CAB | CAC | H8 | 0.9° | 0.1° |
| CAB | CAA | CAF | CAE | 1.9° | 0.0° |
| CAB | CAA | CAF | H6 | 180.0° | 180.0° |
| CAB | CAA | CAF | OAG | 179.5° | 179.9° |
| CAA | CAB | OAR | H7 | 0.6° | 90.0° |
| CAA | CAB | CAC | H8 | 178.4° | 179.9° |
| OAQ | CAH | CAE | CAI | 177.2° | 179.7° |
| OAQ | CAH | CAE | CAF | 174.7° | 180.0° |
| OAQ | CAH | CAI | CAJ | 172.6° | 179.8° |
| OAQ | CAH | CAI | H10 | 7.4° | 0.4° |
| CAH | CAE | CAF | CAA | 179.8° | 180.0° |
| CAH | CAE | CAF | OAG | 2.5° | 0.0° |
| CAE | CAH | CAI | CAJ | 4.7° | 0.5° |
| CAH | CAE | CAD | H9 | 1.1° | 0.0° |
| CAE | CAH | CAI | H10 | 175.3° | 179.9° |
| CAF | CAE | CAH | CAI | 2.5° | 0.3° |
| CAE | CAF | CAA | OAG | 177.6° | 180.0° |
| CAE | CAF | OAG | CAJ | 5.3° | 0.0° |
| CAE | CAF | CAA | H6 | 178.1° | 180.0° |
| CAF | CAE | CAD | H9 | 177.7° | 179.9° |
| CAH | CAI | CAJ | H10 | 180.0° | 179.4° |
| CAH | CAI | CAJ | OAG | 2.0° | 0.6° |
| CAH | CAI | CAJ | CAK | 178.8° | 179.7° |
| CAA | CAF | OAG | CAJ | 177.0° | 180.0° |
| CAF | OAG | CAJ | CAI | 3.1° | 0.3° |
| CAF | OAG | CAJ | CAK | 174.1° | 180.0° |
| OAG | CAF | CAA | H6 | 0.5° | 0.0° |
| CAI | CAJ | OAG | CAK | 177.2° | 179.7° |
| CAI | CAJ | CAK | CAM | 4.4° | 179.7° |
| CAI | CAJ | CAK | CAN | 176.8° | 0.2° |
| OAG | CAJ | CAK | CAM | 172.6° | 0.0° |
| OAG | CAJ | CAK | CAN | 6.1° | 179.5° |
| OAG | CAJ | CAI | H10 | 177.9° | 180.0° |
| CAJ | CAK | CAM | CAN | 178.7° | 179.6° |
| CAJ | CAK | CAM | CAL | 178.3° | 179.9° |
| CAJ | CAK | CAN | CAO | 178.7° | 179.9° |
| CAJ | CAK | CAM | H1 | 1.7° | 0.3° |
| CAJ | CAK | CAN | H5 | 1.3° | 0.2° |
| CAK | CAJ | CAI | H10 | 1.2° | 0.3° |
| CAK | CAM | CAL | H1 | 180.0° | 179.6° |
| CAM | CAK | CAN | CAO | 0.1° | 0.5° |
| CAK | CAM | CAL | OAT | 178.6° | 179.8° |
| CAK | CAM | CAL | CAP | 0.3° | 0.3° |
| CAM | CAK | CAN | H5 | 179.9° | 179.8° |
| CAN | CAK | CAM | CAL | 0.4° | 0.5° |
| CAK | CAN | CAO | H5 | 180.0° | 179.7° |
| CAK | CAN | CAO | CAP | 0.2° | 0.3° |
| CAN | CAK | CAM | H1 | 179.6° | 179.9° |
| CAK | CAN | CAO | H4 | 179.8° | 179.8° |
| CAM | CAL | OAT | CAP | 179.0° | 180.0° |
| CAM | CAL | CAP | CAO | 0.0° | 0.0° |
| CAM | CAL | CAP | OAS | 179.1° | 179.9° |
| CAM | CAL | OAT | H2 | 180.0° | 90.1° |
| CAN | CAO | CAP | CAL | 0.2° | 0.0° |
| CAN | CAO | CAP | H4 | 180.0° | 179.9° |
| CAN | CAO | CAP | OAS | 179.3° | 179.9° |
| OAT | CAL | CAP | CAO | 179.0° | 180.0° |
| OAT | CAL | CAP | OAS | 1.9° | 0.0° |
| OAT | CAL | CAM | H1 | 1.4° | 0.1° |
| CAL | CAP | CAO | OAS | 179.1° | 180.0° |
| CAP | CAL | CAM | H1 | 179.6° | 179.9° |
| CAP | CAL | OAT | H2 | 1.0° | 90.0° |
| CAL | CAP | OAS | H3 | 180.0° | 90.0° |
| CAL | CAP | CAO | H4 | 179.8° | 180.0° |
| CAO | CAP | OAS | H3 | 0.9° | 90.0° |
| CAP | CAO | CAN | H5 | 179.8° | 180.0° |
| OAS | CAP | CAO | H4 | 0.7° | 0.0° |
| H4 | CAO | CAN | H5 | 0.2° | 0.1° |
| H8 | CAC | CAD | H9 | 0.0° | 0.1° |
