VA9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OBK | CBJ | doub | 1.21Å | 1.23Å | |
| CBE | CBD | doub | 1.38Å | 1.38Å | Aromatic |
| CBE | CBF | sing | 1.39Å | 1.38Å | Aromatic |
| OBM | CBF | sing | 1.36Å | 1.36Å | |
| OAS | CAQ | doub | 1.21Å | 1.24Å | |
| CBD | CBC | sing | 1.38Å | 1.39Å | Aromatic |
| CBF | CBA | doub | 1.40Å | 1.41Å | Aromatic |
| OAR | CAQ | sing | 1.35Å | 1.24Å | |
| CBJ | NBI | sing | 1.35Å | 1.35Å | |
| CBJ | CBL | sing | 1.51Å | 1.53Å | |
| OAO | CAN | sing | 1.36Å | 1.36Å | |
| CAQ | CAF | sing | 1.48Å | 1.43Å | |
| NBI | CBH | sing | 1.46Å | 1.48Å | |
| OAP | CAJ | doub | 1.22Å | 1.22Å | |
| CBC | CBG | sing | 1.51Å | 1.39Å | |
| CBC | CBB | doub | 1.38Å | 1.39Å | Aromatic |
| CBA | CBB | sing | 1.39Å | 1.39Å | Aromatic |
| CBA | CAM | sing | 1.48Å | 1.41Å | |
| OAU | CAT | doub | 1.21Å | 1.24Å | |
| CAN | CAM | doub | 1.40Å | 1.41Å | Aromatic |
| CAN | CAI | sing | 1.39Å | 1.38Å | Aromatic |
| CAJ | CAI | sing | 1.47Å | 1.39Å | |
| CAJ | CAE | sing | 1.48Å | 1.42Å | |
| CBG | CBH | sing | 1.53Å | 1.54Å | |
| CAF | CAE | doub | 1.40Å | 1.45Å | Aromatic |
| CAF | CAA | sing | 1.41Å | 1.44Å | Aromatic |
| CAM | CAL | sing | 1.39Å | 1.40Å | Aromatic |
| CAI | CAH | doub | 1.41Å | 1.37Å | Aromatic |
| CAE | CAD | sing | 1.41Å | 1.41Å | Aromatic |
| CAT | CAA | sing | 1.48Å | 1.42Å | |
| CAT | OAV | sing | 1.35Å | 1.25Å | |
| CAA | CAB | doub | 1.40Å | 1.39Å | Aromatic |
| CAL | OAZ | sing | 1.36Å | 1.36Å | |
| CAL | CAK | doub | 1.40Å | 1.39Å | Aromatic |
| CAH | CAK | sing | 1.40Å | 1.39Å | Aromatic |
| CAH | CAG | sing | 1.47Å | 1.37Å | |
| CAD | CAG | sing | 1.48Å | 1.39Å | |
| CAD | CAC | doub | 1.39Å | 1.37Å | Aromatic |
| CAB | CAC | sing | 1.39Å | 1.37Å | Aromatic |
| CAB | OAW | sing | 1.35Å | 1.35Å | |
| CAK | OAY | sing | 1.36Å | 1.36Å | |
| CAG | OAX | doub | 1.22Å | 1.22Å | |
| CAC | H1 | sing | 1.08Å | 1.08Å | |
| CBB | H2 | sing | 1.08Å | 1.08Å | |
| CBD | H3 | sing | 1.08Å | 1.08Å | |
| CBE | H4 | sing | 1.08Å | 1.08Å | |
| CBG | H5 | sing | 1.09Å | 1.10Å | |
| CBG | H6 | sing | 1.09Å | 1.10Å | |
| CBH | H7 | sing | 1.09Å | 1.10Å | |
| CBH | H8 | sing | 1.09Å | 1.10Å | |
| CBL | H9 | sing | 1.09Å | 1.10Å | |
| CBL | H10 | sing | 1.09Å | 1.10Å | |
| CBL | H11 | sing | 1.09Å | 1.10Å | |
| NBI | H12 | sing | 0.97Å | 1.00Å | |
| OAO | H13 | sing | 0.97Å | 0.95Å | |
| OAR | H14 | sing | 0.97Å | 0.95Å | |
| OAV | H15 | sing | 0.97Å | 0.95Å | |
| OAW | H16 | sing | 0.97Å | 0.95Å | |
| OAY | H17 | sing | 0.97Å | 0.95Å | |
| OAZ | H18 | sing | 0.97Å | 0.95Å | |
| OBM | H19 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OBK | CBJ | NBI | 123.9° | 120.0° |
| OBK | CBJ | CBL | 120.4° | 120.0° |
| CBD | CBE | CBF | 119.3° | 120.1° |
| CBE | CBD | CBC | 119.0° | 120.3° |
| CBE | CBD | H3 | 120.5° | 119.8° |
| CBD | CBE | H4 | 120.3° | 119.9° |
| CBE | CBF | OBM | 118.3° | 120.1° |
| CBE | CBF | CBA | 123.3° | 119.7° |
| CBF | CBE | H4 | 120.3° | 120.0° |
| OBM | CBF | CBA | 118.2° | 120.1° |
| CBF | OBM | H19 | 109.5° | 114.0° |
| OAS | CAQ | OAR | 112.3° | 120.1° |
| OAS | CAQ | CAF | 122.4° | 120.0° |
| CBD | CBC | CBG | 118.4° | 119.8° |
| CBD | CBC | CBB | 120.8° | 120.3° |
| CBC | CBD | H3 | 120.5° | 119.9° |
| CBF | CBA | CBB | 115.1° | 119.6° |
| CBF | CBA | CAM | 120.7° | 120.2° |
| OAR | CAQ | CAF | 123.7° | 120.0° |
| CAQ | OAR | H14 | 109.5° | 117.0° |
| NBI | CBJ | CBL | 115.6° | 120.0° |
| CBJ | NBI | CBH | 123.2° | 120.0° |
| CBJ | NBI | H12 | 118.4° | 120.0° |
| CBJ | CBL | H9 | 109.5° | 109.5° |
| CBJ | CBL | H10 | 109.5° | 109.4° |
| CBJ | CBL | H11 | 109.5° | 109.4° |
| OAO | CAN | CAM | 119.4° | 120.0° |
| OAO | CAN | CAI | 115.1° | 120.1° |
| CAN | OAO | H13 | 109.5° | 114.1° |
| CAQ | CAF | CAE | 122.0° | 120.2° |
| CAQ | CAF | CAA | 120.5° | 120.2° |
| NBI | CBH | CBG | 110.8° | 109.5° |
| NBI | CBH | H7 | 109.2° | 109.5° |
| NBI | CBH | H8 | 109.1° | 109.5° |
| CBH | NBI | H12 | 118.4° | 120.0° |
| OAP | CAJ | CAI | 113.7° | 120.3° |
| OAP | CAJ | CAE | 124.3° | 120.4° |
| CBG | CBC | CBB | 120.7° | 119.9° |
| CBC | CBG | CBH | 106.7° | 109.5° |
| CBC | CBG | H5 | 110.1° | 109.5° |
| CBC | CBG | H6 | 110.2° | 109.5° |
| CBC | CBB | CBA | 121.5° | 119.9° |
| CBC | CBB | H2 | 119.2° | 120.1° |
| CBB | CBA | CAM | 122.7° | 120.2° |
| CBA | CBB | H2 | 119.3° | 120.0° |
| CBA | CAM | CAN | 118.4° | 120.0° |
| CBA | CAM | CAL | 126.4° | 119.9° |
| OAU | CAT | CAA | 125.7° | 120.0° |
| OAU | CAT | OAV | 115.6° | 120.0° |
| CAM | CAN | CAI | 125.3° | 119.8° |
| CAN | CAM | CAL | 113.0° | 120.1° |
| CAN | CAI | CAJ | 118.6° | 120.5° |
| CAN | CAI | CAH | 119.0° | 119.9° |
| CAI | CAJ | CAE | 122.0° | 119.3° |
| CAJ | CAI | CAH | 122.5° | 119.6° |
| CAJ | CAE | CAF | 127.2° | 120.4° |
| CAJ | CAE | CAD | 113.1° | 119.7° |
| CBH | CBG | H5 | 110.2° | 109.4° |
| CBH | CBG | H6 | 110.1° | 109.5° |
| CBG | CBH | H7 | 109.1° | 109.5° |
| CBG | CBH | H8 | 109.1° | 109.5° |
| CAE | CAF | CAA | 117.1° | 119.6° |
| CAF | CAE | CAD | 119.5° | 119.9° |
| CAF | CAA | CAT | 131.4° | 120.1° |
| CAF | CAA | CAB | 119.0° | 119.9° |
| CAM | CAL | OAZ | 120.4° | 119.8° |
| CAM | CAL | CAK | 121.4° | 120.3° |
| CAI | CAH | CAK | 118.2° | 119.9° |
| CAI | CAH | CAG | 117.9° | 119.7° |
| CAE | CAD | CAG | 124.2° | 119.5° |
| CAE | CAD | CAC | 121.6° | 120.1° |
| CAA | CAT | OAV | 118.7° | 120.0° |
| CAT | CAA | CAB | 109.5° | 120.0° |
| CAT | OAV | H15 | 109.5° | 117.0° |
| CAA | CAB | CAC | 123.5° | 120.3° |
| CAA | CAB | OAW | 117.0° | 119.9° |
| OAZ | CAL | CAK | 116.8° | 119.8° |
| CAL | OAZ | H18 | 109.5° | 114.0° |
| CAL | CAK | CAH | 121.7° | 119.9° |
| CAL | CAK | OAY | 119.2° | 120.1° |
| CAK | CAH | CAG | 123.8° | 120.4° |
| CAH | CAK | OAY | 119.0° | 120.0° |
| CAH | CAG | CAD | 120.2° | 119.2° |
| CAH | CAG | OAX | 119.8° | 120.4° |
| CAG | CAD | CAC | 114.2° | 120.4° |
| CAD | CAG | OAX | 120.0° | 120.4° |
| CAD | CAC | CAB | 119.1° | 120.2° |
| CAD | CAC | H1 | 120.4° | 119.9° |
| CAC | CAB | OAW | 119.5° | 119.9° |
| CAB | CAC | H1 | 120.5° | 119.9° |
| CAB | OAW | H16 | 109.5° | 114.1° |
| CAK | OAY | H17 | 109.5° | 114.0° |
| H5 | CBG | H6 | 109.5° | 109.5° |
| H7 | CBH | H8 | 109.5° | 109.5° |
| H9 | CBL | H10 | 109.4° | 109.5° |
| H9 | CBL | H11 | 109.4° | 109.5° |
| H10 | CBL | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OBK | CBJ | NBI | CBL | 179.5° | 180.0° |
| OBK | CBJ | NBI | CBH | 179.5° | 0.0° |
| OBK | CBJ | CBL | H9 | 0.0° | 90.0° |
| OBK | CBJ | CBL | H10 | 120.0° | 30.0° |
| OBK | CBJ | CBL | H11 | 120.0° | 150.0° |
| OBK | CBJ | NBI | H12 | 0.5° | 180.0° |
| CBD | CBE | CBF | H4 | 180.0° | 179.8° |
| CBD | CBE | CBF | OBM | 180.0° | 180.0° |
| CBE | CBD | CBC | H3 | 180.0° | 180.0° |
| CBD | CBE | CBF | CBA | 4.6° | 0.6° |
| CBE | CBD | CBC | CBG | 178.7° | 180.0° |
| CBE | CBD | CBC | CBB | 2.0° | 0.0° |
| CBE | CBF | OBM | CBA | 175.7° | 179.4° |
| CBF | CBE | CBD | CBC | 0.4° | 0.3° |
| CBE | CBF | CBA | CBB | 9.7° | 0.6° |
| CBE | CBF | CBA | CAM | 176.2° | 179.8° |
| CBF | CBE | CBD | H3 | 179.6° | 179.7° |
| CBE | CBF | OBM | H19 | 180.0° | 90.0° |
| OBM | CBF | CBA | CBB | 174.9° | 180.0° |
| OBM | CBF | CBA | CAM | 8.3° | 0.4° |
| OBM | CBF | CBE | H4 | 0.0° | 0.2° |
| OAS | CAQ | OAR | CAF | 165.9° | 180.0° |
| OAS | CAQ | CAF | CAE | 23.1° | 90.0° |
| OAS | CAQ | CAF | CAA | 149.3° | 90.0° |
| OAS | CAQ | OAR | H14 | 0.0° | 0.1° |
| CBD | CBC | CBG | CBB | 179.3° | 179.9° |
| CBD | CBC | CBB | CBA | 7.8° | 0.0° |
| CBD | CBC | CBG | CBH | 94.3° | 90.0° |
| CBD | CBC | CBB | H2 | 172.3° | 179.9° |
| CBC | CBD | CBE | H4 | 179.6° | 180.0° |
| CBD | CBC | CBG | H5 | 146.1° | 29.9° |
| CBD | CBC | CBG | H6 | 25.3° | 149.9° |
| CBF | CBA | CBB | CBC | 11.1° | 0.3° |
| CBF | CBA | CBB | CAM | 166.2° | 179.6° |
| CBF | CBA | CAM | CAN | 48.4° | 89.7° |
| CBF | CBA | CAM | CAL | 150.1° | 90.3° |
| CBF | CBA | CBB | H2 | 168.9° | 179.8° |
| CBA | CBF | CBE | H4 | 175.4° | 179.7° |
| CBA | CBF | OBM | H19 | 4.3° | 90.6° |
| OAR | CAQ | CAF | CAE | 172.3° | 90.0° |
| OAR | CAQ | CAF | CAA | 15.2° | 90.0° |
| CBJ | NBI | CBH | H12 | 180.0° | 180.0° |
| CBJ | NBI | CBH | CBG | 113.1° | 180.0° |
| CBJ | NBI | CBH | H7 | 126.7° | 60.0° |
| CBJ | NBI | CBH | H8 | 7.1° | 60.0° |
| NBI | CBJ | CBL | H9 | 179.5° | 90.0° |
| NBI | CBJ | CBL | H10 | 59.5° | 150.0° |
| NBI | CBJ | CBL | H11 | 60.5° | 30.0° |
| CBL | CBJ | NBI | CBH | 0.0° | 180.0° |
| CBJ | CBL | H9 | H10 | 120.0° | 120.0° |
| CBJ | CBL | H9 | H11 | 120.0° | 120.0° |
| CBJ | CBL | H10 | H11 | 120.0° | 119.9° |
| CBL | CBJ | NBI | H12 | 180.0° | 0.0° |
| OAO | CAN | CAM | CBA | 10.1° | 0.0° |
| OAO | CAN | CAM | CAI | 174.5° | 180.0° |
| OAO | CAN | CAI | CAJ | 0.4° | 0.1° |
| OAO | CAN | CAM | CAL | 174.0° | 180.0° |
| OAO | CAN | CAI | CAH | 180.0° | 179.9° |
| CAQ | CAF | CAE | CAJ | 7.1° | 0.0° |
| CAQ | CAF | CAE | CAA | 172.7° | 180.0° |
| CAQ | CAF | CAE | CAD | 178.3° | 180.0° |
| CAQ | CAF | CAA | CAT | 5.7° | 0.3° |
| CAQ | CAF | CAA | CAB | 177.7° | 180.0° |
| CAF | CAQ | OAR | H14 | 165.9° | 180.0° |
| NBI | CBH | CBG | CBC | 59.2° | 180.0° |
| NBI | CBH | CBG | H7 | 120.2° | 120.0° |
| NBI | CBH | CBG | H8 | 120.2° | 120.0° |
| NBI | CBH | CBG | H5 | 178.8° | 60.0° |
| NBI | CBH | CBG | H6 | 60.3° | 60.0° |
| NBI | CBH | H7 | H8 | 119.4° | 120.0° |
| OAP | CAJ | CAI | CAN | 0.0° | 13.8° |
| OAP | CAJ | CAI | CAE | 179.2° | 179.9° |
| OAP | CAJ | CAE | CAF | 4.0° | 13.9° |
| OAP | CAJ | CAI | CAH | 179.6° | 166.2° |
| OAP | CAJ | CAE | CAD | 178.9° | 166.2° |
| CBG | CBC | CBB | CBA | 173.0° | 180.0° |
| CBC | CBG | CBH | H5 | 119.6° | 120.0° |
| CBC | CBG | CBH | H6 | 119.6° | 120.0° |
| CBG | CBC | CBB | H2 | 7.0° | 0.0° |
| CBG | CBC | CBD | H3 | 1.3° | 0.1° |
| CBC | CBG | H5 | H6 | 121.3° | 120.0° |
| CBC | CBG | CBH | H7 | 179.4° | 60.0° |
| CBC | CBG | CBH | H8 | 61.0° | 60.0° |
| CBC | CBB | CBA | H2 | 180.0° | 179.9° |
| CBC | CBB | CBA | CAM | 177.3° | 179.9° |
| CBB | CBC | CBG | CBH | 86.4° | 90.0° |
| CBB | CBC | CBD | H3 | 178.0° | 180.0° |
| CBB | CBC | CBG | H5 | 33.2° | 150.0° |
| CBB | CBC | CBG | H6 | 154.0° | 30.0° |
| CBB | CBA | CAM | CAN | 146.1° | 89.9° |
| CBB | CBA | CAM | CAL | 15.4° | 90.0° |
| CBA | CAM | CAN | CAL | 163.9° | 180.0° |
| CBA | CAM | CAN | CAI | 175.4° | 180.0° |
| CBA | CAM | CAL | OAZ | 17.4° | 0.0° |
| CBA | CAM | CAL | CAK | 176.0° | 179.9° |
| CAM | CBA | CBB | H2 | 2.7° | 0.1° |
| OAU | CAT | CAA | CAF | 1.0° | 90.3° |
| OAU | CAT | CAA | OAV | 178.5° | 180.0° |
| OAU | CAT | CAA | CAB | 175.8° | 90.0° |
| OAU | CAT | OAV | H15 | 0.0° | 0.1° |
| CAM | CAN | CAI | CAJ | 175.2° | 180.0° |
| CAM | CAN | CAI | CAH | 5.3° | 0.0° |
| CAN | CAM | CAL | OAZ | 179.7° | 179.9° |
| CAN | CAM | CAL | CAK | 13.6° | 0.1° |
| CAM | CAN | OAO | H13 | 175.5° | 90.0° |
| CAN | CAI | CAJ | CAH | 179.5° | 180.0° |
| CAN | CAI | CAJ | CAE | 179.2° | 166.1° |
| CAI | CAN | CAM | CAL | 11.5° | 0.1° |
| CAN | CAI | CAH | CAK | 0.5° | 0.1° |
| CAN | CAI | CAH | CAG | 179.7° | 180.0° |
| CAI | CAN | OAO | H13 | 0.4° | 90.1° |
| CAI | CAJ | CAE | CAF | 176.9° | 166.0° |
| CAI | CAJ | CAE | CAD | 2.0° | 13.9° |
| CAJ | CAI | CAH | CAK | 180.0° | 179.9° |
| CAJ | CAI | CAH | CAG | 0.1° | 0.0° |
| CAJ | CAE | CAF | CAD | 174.6° | 179.9° |
| CAJ | CAE | CAF | CAA | 179.8° | 180.0° |
| CAE | CAJ | CAI | CAH | 1.2° | 13.9° |
| CAJ | CAE | CAD | CAG | 2.0° | 0.0° |
| CAJ | CAE | CAD | CAC | 179.1° | 180.0° |
| CBH | CBG | H5 | H6 | 121.3° | 120.0° |
| CBG | CBH | H7 | H8 | 119.4° | 120.0° |
| CBG | CBH | NBI | H12 | 66.9° | 0.0° |
| CAE | CAF | CAA | CAT | 178.5° | 179.7° |
| CAE | CAF | CAA | CAB | 4.9° | 0.0° |
| CAF | CAE | CAD | CAG | 177.3° | 179.9° |
| CAF | CAE | CAD | CAC | 3.8° | 0.1° |
| CAA | CAF | CAE | CAD | 5.6° | 0.1° |
| CAF | CAA | CAT | CAB | 176.8° | 179.7° |
| CAF | CAA | CAT | OAV | 177.5° | 89.7° |
| CAF | CAA | CAB | CAC | 2.4° | 0.1° |
| CAF | CAA | CAB | OAW | 178.2° | 180.0° |
| CAM | CAL | OAZ | CAK | 167.3° | 180.0° |
| CAM | CAL | CAK | CAH | 10.3° | 0.0° |
| CAM | CAL | CAK | OAY | 172.8° | 179.9° |
| CAM | CAL | OAZ | H18 | 180.0° | 90.0° |
| CAI | CAH | CAK | CAL | 3.0° | 0.0° |
| CAI | CAH | CAK | CAG | 179.8° | 179.9° |
| CAI | CAH | CAG | CAD | 0.0° | 13.9° |
| CAI | CAH | CAK | OAY | 180.0° | 180.0° |
| CAI | CAH | CAG | OAX | 179.7° | 166.1° |
| CAE | CAD | CAG | CAH | 1.1° | 13.9° |
| CAE | CAD | CAG | CAC | 178.9° | 180.0° |
| CAE | CAD | CAC | CAB | 1.1° | 0.0° |
| CAE | CAD | CAG | OAX | 178.7° | 166.1° |
| CAE | CAD | CAC | H1 | 178.9° | 179.9° |
| CAT | CAA | CAB | CAC | 179.7° | 179.6° |
| CAT | CAA | CAB | OAW | 0.9° | 0.3° |
| CAA | CAT | OAV | H15 | 178.7° | 180.0° |
| OAV | CAT | CAA | CAB | 5.7° | 90.0° |
| CAA | CAB | CAC | CAD | 0.4° | 0.1° |
| CAA | CAB | CAC | OAW | 179.4° | 179.9° |
| CAA | CAB | CAC | H1 | 179.6° | 180.0° |
| CAA | CAB | OAW | H16 | 180.0° | 90.0° |
| OAZ | CAL | CAK | CAH | 177.4° | 180.0° |
| OAZ | CAL | CAK | OAY | 5.6° | 0.0° |
| CAL | CAK | CAH | OAY | 176.9° | 180.0° |
| CAL | CAK | CAH | CAG | 177.1° | 180.0° |
| CAL | CAK | OAY | H17 | 177.3° | 90.0° |
| CAK | CAL | OAZ | H18 | 12.7° | 90.0° |
| CAK | CAH | CAG | CAD | 179.9° | 166.0° |
| CAK | CAH | CAG | OAX | 0.1° | 14.0° |
| CAH | CAK | OAY | H17 | 0.3° | 90.0° |
| CAH | CAG | CAD | OAX | 179.7° | 180.0° |
| CAH | CAG | CAD | CAC | 180.0° | 166.1° |
| CAG | CAH | CAK | OAY | 0.2° | 0.1° |
| CAG | CAD | CAC | CAB | 179.9° | 180.0° |
| CAG | CAD | CAC | H1 | 0.0° | 0.1° |
| CAD | CAC | CAB | H1 | 180.0° | 179.9° |
| CAD | CAC | CAB | OAW | 179.8° | 180.0° |
| CAC | CAD | CAG | OAX | 0.3° | 13.9° |
| CAC | CAB | OAW | H16 | 0.6° | 90.0° |
| OAW | CAB | CAC | H1 | 0.2° | 0.1° |
| H3 | CBD | CBE | H4 | 0.4° | 0.1° |
| H5 | CBG | CBH | H7 | 61.0° | 180.0° |
| H5 | CBG | CBH | H8 | 58.6° | 60.0° |
| H6 | CBG | CBH | H7 | 59.9° | 60.0° |
| H6 | CBG | CBH | H8 | 179.5° | 180.0° |
| H7 | CBH | NBI | H12 | 53.3° | 120.0° |
| H8 | CBH | NBI | H12 | 172.9° | 120.0° |
| H9 | CBL | H10 | H11 | 119.9° | 120.1° |
