NB7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAQ | CAJ | doub | 1.21Å | 1.26Å | |
| CAN | CAO | doub | 1.38Å | 1.40Å | Aromatic |
| CAN | CAK | sing | 1.40Å | 1.39Å | Aromatic |
| CAO | CAP | sing | 1.38Å | 1.40Å | Aromatic |
| CAJ | CAK | sing | 1.48Å | 1.40Å | |
| CAJ | NAI | sing | 1.35Å | 1.40Å | |
| CAK | CAM | doub | 1.40Å | 1.41Å | Aromatic |
| NAH | NAI | sing | 1.40Å | 1.53Å | |
| NAH | SAG | sing | 1.66Å | 1.81Å | |
| OAR | SAG | doub | 1.42Å | 1.55Å | |
| CAP | CAL | doub | 1.38Å | 1.38Å | Aromatic |
| SAG | OAS | doub | 1.42Å | 1.46Å | |
| SAG | CAF | sing | 1.76Å | 1.83Å | |
| CAM | CAL | sing | 1.38Å | 1.40Å | Aromatic |
| CAF | CAE | doub | 1.38Å | 1.39Å | Aromatic |
| CAF | CAA | sing | 1.38Å | 1.38Å | Aromatic |
| CAE | CAD | sing | 1.38Å | 1.40Å | Aromatic |
| FAT | CAA | sing | 1.35Å | 1.37Å | |
| CAA | CAB | doub | 1.38Å | 1.40Å | Aromatic |
| CAD | CAC | doub | 1.38Å | 1.39Å | Aromatic |
| CAB | CAC | sing | 1.38Å | 1.40Å | Aromatic |
| CAB | H1 | sing | 1.08Å | 1.08Å | |
| CAC | H2 | sing | 1.08Å | 1.08Å | |
| CAD | H3 | sing | 1.08Å | 1.08Å | |
| CAE | H4 | sing | 1.08Å | 1.08Å | |
| CAL | H5 | sing | 1.08Å | 1.08Å | |
| CAM | H6 | sing | 1.08Å | 1.08Å | |
| CAN | H7 | sing | 1.08Å | 1.08Å | |
| CAO | H8 | sing | 1.08Å | 1.08Å | |
| CAP | H9 | sing | 1.08Å | 1.08Å | |
| NAH | H10 | sing | 0.97Å | 1.00Å | |
| NAI | H11 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAQ | CAJ | CAK | 118.0° | 120.0° |
| OAQ | CAJ | NAI | 126.8° | 120.0° |
| CAO | CAN | CAK | 118.7° | 119.8° |
| CAN | CAO | CAP | 122.3° | 120.2° |
| CAO | CAN | H7 | 120.6° | 120.1° |
| CAN | CAO | H8 | 118.8° | 119.9° |
| CAN | CAK | CAJ | 115.5° | 120.1° |
| CAN | CAK | CAM | 118.5° | 119.7° |
| CAK | CAN | H7 | 120.7° | 120.1° |
| CAO | CAP | CAL | 118.8° | 120.3° |
| CAP | CAO | H8 | 118.8° | 120.0° |
| CAO | CAP | H9 | 120.6° | 119.8° |
| CAK | CAJ | NAI | 113.3° | 120.0° |
| CAJ | CAK | CAM | 125.7° | 120.2° |
| CAJ | NAI | NAH | 127.0° | 120.0° |
| CAJ | NAI | H11 | 116.4° | 120.1° |
| CAK | CAM | CAL | 122.0° | 119.9° |
| CAK | CAM | H6 | 119.0° | 120.0° |
| NAI | NAH | SAG | 109.2° | 120.0° |
| NAI | NAH | H10 | 109.5° | 120.0° |
| NAH | NAI | H11 | 116.5° | 120.0° |
| NAH | SAG | OAR | 109.5° | 106.4° |
| NAH | SAG | OAS | 115.2° | 106.4° |
| NAH | SAG | CAF | 105.4° | 107.2° |
| SAG | NAH | H10 | 109.6° | 120.0° |
| OAR | SAG | OAS | 112.8° | 123.2° |
| OAR | SAG | CAF | 107.8° | 106.4° |
| CAP | CAL | CAM | 119.2° | 120.1° |
| CAP | CAL | H5 | 120.4° | 120.0° |
| CAL | CAP | H9 | 120.6° | 119.8° |
| OAS | SAG | CAF | 105.4° | 106.4° |
| SAG | CAF | CAE | 118.4° | 120.0° |
| SAG | CAF | CAA | 122.7° | 120.0° |
| CAM | CAL | H5 | 120.4° | 119.9° |
| CAL | CAM | H6 | 119.0° | 120.1° |
| CAE | CAF | CAA | 118.8° | 120.0° |
| CAF | CAE | CAD | 120.8° | 120.0° |
| CAF | CAE | H4 | 119.6° | 120.0° |
| CAF | CAA | FAT | 119.4° | 120.0° |
| CAF | CAA | CAB | 121.3° | 119.9° |
| CAE | CAD | CAC | 119.7° | 120.0° |
| CAE | CAD | H3 | 120.2° | 120.0° |
| CAD | CAE | H4 | 119.6° | 120.0° |
| FAT | CAA | CAB | 119.2° | 120.0° |
| CAA | CAB | CAC | 119.4° | 120.0° |
| CAA | CAB | H1 | 120.3° | 120.0° |
| CAD | CAC | CAB | 119.9° | 120.0° |
| CAD | CAC | H2 | 120.1° | 120.0° |
| CAC | CAD | H3 | 120.2° | 119.9° |
| CAC | CAB | H1 | 120.3° | 120.0° |
| CAB | CAC | H2 | 120.1° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAQ | CAJ | CAK | CAN | 37.9° | 179.7° |
| OAQ | CAJ | CAK | NAI | 165.2° | 180.0° |
| OAQ | CAJ | CAK | CAM | 136.8° | 0.0° |
| OAQ | CAJ | NAI | NAH | 16.9° | 0.0° |
| OAQ | CAJ | NAI | H11 | 163.1° | 180.0° |
| CAO | CAN | CAK | H7 | 180.0° | 180.0° |
| CAN | CAO | CAP | H8 | 180.0° | 180.0° |
| CAO | CAN | CAK | CAJ | 176.7° | 180.0° |
| CAO | CAN | CAK | CAM | 8.1° | 0.3° |
| CAN | CAO | CAP | CAL | 2.4° | 0.3° |
| CAN | CAO | CAP | H9 | 177.6° | 180.0° |
| CAK | CAN | CAO | CAP | 6.6° | 0.0° |
| CAN | CAK | CAJ | CAM | 174.7° | 179.7° |
| CAN | CAK | CAJ | NAI | 156.9° | 0.3° |
| CAN | CAK | CAM | CAL | 5.9° | 0.3° |
| CAN | CAK | CAM | H6 | 174.1° | 179.7° |
| CAK | CAN | CAO | H8 | 173.4° | 180.0° |
| CAO | CAP | CAL | H9 | 180.0° | 179.7° |
| CAO | CAP | CAL | CAM | 0.2° | 0.3° |
| CAO | CAP | CAL | H5 | 179.8° | 179.7° |
| CAP | CAO | CAN | H7 | 173.4° | 180.0° |
| CAK | CAJ | NAI | NAH | 179.4° | 180.0° |
| CAJ | CAK | CAM | CAL | 179.6° | 180.0° |
| CAJ | CAK | CAM | H6 | 0.5° | 0.0° |
| CAJ | CAK | CAN | H7 | 3.2° | 0.0° |
| CAK | CAJ | NAI | H11 | 0.6° | 0.0° |
| NAI | CAJ | CAK | CAM | 28.4° | 180.0° |
| CAJ | NAI | NAH | H11 | 180.0° | 180.0° |
| CAJ | NAI | NAH | SAG | 96.9° | 125.0° |
| CAJ | NAI | NAH | H10 | 143.1° | 55.0° |
| CAK | CAM | CAL | CAP | 1.6° | 0.0° |
| CAK | CAM | CAL | H6 | 180.0° | 180.0° |
| CAK | CAM | CAL | H5 | 178.4° | 180.0° |
| CAM | CAK | CAN | H7 | 171.9° | 179.7° |
| NAI | NAH | SAG | H10 | 119.9° | 180.0° |
| NAI | NAH | SAG | OAR | 158.8° | 53.5° |
| NAI | NAH | SAG | OAS | 30.3° | 173.6° |
| NAI | NAH | SAG | CAF | 85.5° | 60.0° |
| NAH | SAG | OAR | OAS | 129.8° | 122.9° |
| NAH | SAG | OAR | CAF | 114.2° | 114.1° |
| NAH | SAG | OAS | CAF | 115.7° | 114.1° |
| NAH | SAG | CAF | CAE | 108.6° | 115.1° |
| NAH | SAG | CAF | CAA | 67.8° | 65.0° |
| SAG | NAH | NAI | H11 | 83.1° | 55.0° |
| OAR | SAG | OAS | CAF | 117.4° | 123.0° |
| OAR | SAG | CAF | CAE | 8.3° | 131.4° |
| OAR | SAG | CAF | CAA | 175.3° | 48.5° |
| OAR | SAG | NAH | H10 | 81.3° | 126.5° |
| CAP | CAL | CAM | H5 | 180.0° | 180.0° |
| CAP | CAL | CAM | H6 | 178.4° | 180.0° |
| CAL | CAP | CAO | H8 | 177.6° | 179.7° |
| OAS | SAG | CAF | CAE | 129.1° | 1.5° |
| OAS | SAG | CAF | CAA | 54.5° | 178.6° |
| OAS | SAG | NAH | H10 | 150.2° | 6.4° |
| SAG | CAF | CAE | CAA | 176.5° | 179.9° |
| SAG | CAF | CAE | CAD | 179.4° | 180.0° |
| SAG | CAF | CAA | FAT | 3.8° | 0.3° |
| SAG | CAF | CAA | CAB | 179.9° | 179.9° |
| SAG | CAF | CAE | H4 | 0.6° | 0.0° |
| CAF | SAG | NAH | H10 | 34.5° | 120.0° |
| CAM | CAL | CAP | H9 | 179.8° | 180.0° |
| CAF | CAE | CAD | H4 | 180.0° | 180.0° |
| CAE | CAF | CAA | FAT | 179.8° | 179.8° |
| CAE | CAF | CAA | CAB | 3.5° | 0.0° |
| CAF | CAE | CAD | CAC | 1.6° | 0.0° |
| CAF | CAE | CAD | H3 | 178.4° | 180.0° |
| CAA | CAF | CAE | CAD | 2.9° | 0.0° |
| CAF | CAA | FAT | CAB | 176.3° | 179.8° |
| CAF | CAA | CAB | CAC | 2.8° | 0.1° |
| CAF | CAA | CAB | H1 | 177.2° | 180.0° |
| CAA | CAF | CAE | H4 | 177.1° | 179.9° |
| CAE | CAD | CAC | H3 | 180.0° | 180.0° |
| CAE | CAD | CAC | CAB | 0.8° | 0.1° |
| CAE | CAD | CAC | H2 | 179.2° | 180.0° |
| FAT | CAA | CAB | CAC | 179.1° | 179.7° |
| FAT | CAA | CAB | H1 | 0.9° | 0.2° |
| CAA | CAB | CAC | CAD | 1.4° | 0.1° |
| CAA | CAB | CAC | H1 | 180.0° | 179.9° |
| CAA | CAB | CAC | H2 | 178.6° | 180.0° |
| CAD | CAC | CAB | H2 | 180.0° | 179.9° |
| CAD | CAC | CAB | H1 | 178.6° | 180.0° |
| CAC | CAD | CAE | H4 | 178.5° | 180.0° |
| CAB | CAC | CAD | H3 | 179.2° | 179.9° |
| H1 | CAB | CAC | H2 | 1.4° | 0.1° |
| H2 | CAC | CAD | H3 | 0.8° | 0.0° |
| H3 | CAD | CAE | H4 | 1.5° | 0.1° |
| H5 | CAL | CAM | H6 | 1.6° | 0.0° |
| H5 | CAL | CAP | H9 | 0.2° | 0.0° |
| H7 | CAN | CAO | H8 | 6.6° | 0.0° |
| H8 | CAO | CAP | H9 | 2.4° | 0.1° |
| H10 | NAH | NAI | H11 | 36.9° | 125.0° |
