7W6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| NAR | CAP | sing | 1.35Å | 1.31Å | |
| OAS | CAP | doub | 1.21Å | 1.22Å | |
| CAT | CAH | sing | 1.51Å | 1.53Å | |
| CAP | CAO | sing | 1.49Å | 1.52Å | |
| CAO | OAQ | doub | 1.22Å | 1.23Å | |
| CAO | CAI | sing | 1.46Å | 1.35Å | |
| CAH | CAI | doub | 1.38Å | 1.32Å | Aromatic |
| CAH | NAG | sing | 1.35Å | 1.34Å | Aromatic |
| CAI | CAF | sing | 1.48Å | 1.36Å | Aromatic |
| NAG | CAU | sing | 1.46Å | 1.54Å | |
| NAG | CAE | sing | 1.38Å | 1.34Å | Aromatic |
| CAU | CAV | sing | 1.51Å | 1.43Å | |
| CAF | CAE | doub | 1.40Å | 1.35Å | Aromatic |
| CAF | CAA | sing | 1.40Å | 1.37Å | Aromatic |
| CAE | CAD | sing | 1.39Å | 1.34Å | Aromatic |
| OAJ | CAA | sing | 1.36Å | 1.38Å | |
| OAJ | CAK | sing | 1.43Å | 1.46Å | |
| OAM | CAL | doub | 1.21Å | 1.25Å | |
| CAA | CAB | doub | 1.38Å | 1.40Å | Aromatic |
| CAV | CBA | doub | 1.38Å | 1.41Å | Aromatic |
| CAV | CAW | sing | 1.38Å | 1.41Å | Aromatic |
| CAD | CAC | doub | 1.38Å | 1.39Å | Aromatic |
| CBA | CAZ | sing | 1.38Å | 1.41Å | Aromatic |
| CAW | CAX | doub | 1.38Å | 1.40Å | Aromatic |
| CAL | CAK | sing | 1.51Å | 1.55Å | |
| CAL | OAN | sing | 1.34Å | 1.26Å | |
| CAB | CAC | sing | 1.39Å | 1.38Å | Aromatic |
| CAZ | CAY | doub | 1.38Å | 1.39Å | Aromatic |
| CAZ | BRB | sing | 1.89Å | 1.91Å | |
| CAX | CAY | sing | 1.38Å | 1.39Å | Aromatic |
| OAN | H1 | sing | 0.97Å | 0.95Å | |
| CAK | H2 | sing | 1.09Å | 1.10Å | |
| CAK | H3 | sing | 1.09Å | 1.10Å | |
| CAB | H4 | sing | 1.08Å | 1.08Å | |
| CAC | H5 | sing | 1.08Å | 1.08Å | |
| CAD | H6 | sing | 1.08Å | 1.08Å | |
| NAR | H7 | sing | 0.97Å | 1.00Å | |
| NAR | H8 | sing | 0.97Å | 1.00Å | |
| CAT | H9 | sing | 1.09Å | 1.10Å | |
| CAT | H10 | sing | 1.09Å | 1.10Å | |
| CAT | H11 | sing | 1.09Å | 1.10Å | |
| CAU | H12 | sing | 1.09Å | 1.10Å | |
| CAU | H13 | sing | 1.09Å | 1.10Å | |
| CBA | H14 | sing | 1.08Å | 1.08Å | |
| CAY | H15 | sing | 1.08Å | 1.08Å | |
| CAX | H16 | sing | 1.08Å | 1.08Å | |
| CAW | H17 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAR | CAP | OAS | 122.8° | 120.1° |
| NAR | CAP | CAO | 115.3° | 120.0° |
| CAP | NAR | H7 | 120.0° | 120.0° |
| CAP | NAR | H8 | 120.0° | 119.9° |
| OAS | CAP | CAO | 121.7° | 120.0° |
| CAT | CAH | CAI | 124.5° | 125.2° |
| CAT | CAH | NAG | 126.2° | 125.2° |
| CAH | CAT | H9 | 109.5° | 109.5° |
| CAH | CAT | H10 | 109.4° | 109.5° |
| CAH | CAT | H11 | 109.5° | 109.5° |
| CAP | CAO | OAQ | 118.7° | 120.0° |
| CAP | CAO | CAI | 116.9° | 120.0° |
| OAQ | CAO | CAI | 124.4° | 120.0° |
| CAO | CAI | CAH | 123.8° | 127.0° |
| CAO | CAI | CAF | 127.7° | 126.9° |
| CAI | CAH | NAG | 109.3° | 109.6° |
| CAH | CAI | CAF | 108.5° | 106.1° |
| CAH | NAG | CAU | 129.3° | 124.6° |
| CAH | NAG | CAE | 106.8° | 110.7° |
| CAI | CAF | CAE | 105.6° | 105.8° |
| CAI | CAF | CAA | 135.8° | 134.0° |
| CAU | NAG | CAE | 123.9° | 124.6° |
| NAG | CAU | CAV | 111.0° | 109.5° |
| NAG | CAU | H12 | 109.1° | 109.5° |
| NAG | CAU | H13 | 109.1° | 109.5° |
| NAG | CAE | CAF | 109.7° | 107.7° |
| NAG | CAE | CAD | 128.8° | 133.0° |
| CAU | CAV | CBA | 120.9° | 120.0° |
| CAU | CAV | CAW | 121.3° | 120.0° |
| CAV | CAU | H12 | 109.1° | 109.5° |
| CAV | CAU | H13 | 109.1° | 109.5° |
| CAE | CAF | CAA | 118.6° | 120.2° |
| CAF | CAE | CAD | 121.5° | 119.3° |
| CAF | CAA | OAJ | 119.2° | 120.2° |
| CAF | CAA | CAB | 121.1° | 119.5° |
| CAE | CAD | CAC | 121.9° | 120.0° |
| CAE | CAD | H6 | 119.0° | 119.9° |
| CAA | OAJ | CAK | 120.4° | 117.0° |
| OAJ | CAA | CAB | 119.6° | 120.2° |
| OAJ | CAK | CAL | 112.0° | 109.5° |
| OAJ | CAK | H2 | 108.8° | 109.4° |
| OAJ | CAK | H3 | 108.8° | 109.5° |
| OAM | CAL | CAK | 118.3° | 119.9° |
| OAM | CAL | OAN | 124.7° | 120.0° |
| CAA | CAB | CAC | 119.0° | 120.2° |
| CAA | CAB | H4 | 120.5° | 119.9° |
| CBA | CAV | CAW | 117.8° | 120.0° |
| CAV | CBA | CAZ | 120.8° | 120.0° |
| CAV | CBA | H14 | 119.6° | 120.0° |
| CAV | CAW | CAX | 120.8° | 120.0° |
| CAV | CAW | H17 | 119.6° | 120.0° |
| CAD | CAC | CAB | 117.8° | 120.7° |
| CAD | CAC | H5 | 121.1° | 119.6° |
| CAC | CAD | H6 | 119.1° | 120.0° |
| CBA | CAZ | CAY | 120.2° | 119.9° |
| CBA | CAZ | BRB | 122.0° | 120.0° |
| CAZ | CBA | H14 | 119.6° | 120.0° |
| CAW | CAX | CAY | 120.7° | 120.0° |
| CAW | CAX | H16 | 119.6° | 120.0° |
| CAX | CAW | H17 | 119.6° | 120.0° |
| CAK | CAL | OAN | 116.9° | 120.0° |
| CAL | CAK | H2 | 108.8° | 109.5° |
| CAL | CAK | H3 | 108.9° | 109.5° |
| CAL | OAN | H1 | 109.5° | 117.0° |
| CAC | CAB | H4 | 120.5° | 119.9° |
| CAB | CAC | H5 | 121.1° | 119.7° |
| CAY | CAZ | BRB | 117.8° | 120.1° |
| CAZ | CAY | CAX | 119.6° | 120.0° |
| CAZ | CAY | H15 | 120.2° | 120.0° |
| CAX | CAY | H15 | 120.2° | 120.0° |
| CAY | CAX | H16 | 119.6° | 120.0° |
| H2 | CAK | H3 | 109.5° | 109.4° |
| H7 | NAR | H8 | 120.0° | 120.0° |
| H9 | CAT | H10 | 109.5° | 109.5° |
| H9 | CAT | H11 | 109.5° | 109.5° |
| H10 | CAT | H11 | 109.5° | 109.5° |
| H12 | CAU | H13 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAR | CAP | OAS | CAO | 175.6° | 180.0° |
| NAR | CAP | CAO | OAQ | 6.9° | 5.2° |
| NAR | CAP | CAO | CAI | 175.2° | 174.8° |
| CAP | NAR | H7 | H8 | 180.0° | 180.0° |
| OAS | CAP | CAO | OAQ | 177.2° | 174.7° |
| OAS | CAP | CAO | CAI | 0.7° | 5.3° |
| OAS | CAP | NAR | H7 | 0.0° | 180.0° |
| OAS | CAP | NAR | H8 | 180.0° | 0.0° |
| CAT | CAH | CAI | CAO | 1.2° | 0.1° |
| CAT | CAH | CAI | NAG | 179.6° | 179.9° |
| CAT | CAH | CAI | CAF | 179.1° | 180.0° |
| CAT | CAH | NAG | CAU | 0.8° | 0.1° |
| CAT | CAH | NAG | CAE | 179.4° | 179.8° |
| CAH | CAT | H9 | H10 | 120.0° | 120.0° |
| CAH | CAT | H9 | H11 | 120.0° | 120.0° |
| CAH | CAT | H10 | H11 | 120.0° | 120.0° |
| CAP | CAO | OAQ | CAI | 177.7° | 180.0° |
| CAP | CAO | CAI | CAH | 122.1° | 94.6° |
| CAP | CAO | CAI | CAF | 57.6° | 85.4° |
| CAO | CAP | NAR | H7 | 175.9° | 0.0° |
| CAO | CAP | NAR | H8 | 4.1° | 180.0° |
| OAQ | CAO | CAI | CAH | 55.6° | 85.4° |
| OAQ | CAO | CAI | CAF | 124.6° | 94.6° |
| CAO | CAI | CAH | CAF | 179.8° | 180.0° |
| CAO | CAI | CAH | NAG | 179.2° | 179.8° |
| CAO | CAI | CAF | CAE | 179.1° | 180.0° |
| CAO | CAI | CAF | CAA | 0.3° | 0.7° |
| CAI | CAH | NAG | CAU | 178.8° | 180.0° |
| CAI | CAH | NAG | CAE | 0.2° | 0.3° |
| CAH | CAI | CAF | CAE | 0.7° | 0.1° |
| CAH | CAI | CAF | CAA | 179.4° | 179.3° |
| CAI | CAH | CAT | H9 | 90.2° | 95.0° |
| CAI | CAH | CAT | H10 | 149.8° | 145.0° |
| CAI | CAH | CAT | H11 | 29.8° | 25.0° |
| NAG | CAH | CAI | CAF | 0.6° | 0.2° |
| CAH | NAG | CAU | CAE | 178.4° | 179.6° |
| CAH | NAG | CAU | CAV | 106.3° | 90.0° |
| CAH | NAG | CAE | CAF | 0.2° | 0.3° |
| CAH | NAG | CAE | CAD | 179.5° | 179.9° |
| NAG | CAH | CAT | H9 | 90.2° | 85.1° |
| NAG | CAH | CAT | H10 | 29.8° | 34.9° |
| NAG | CAH | CAT | H11 | 149.8° | 154.9° |
| CAH | NAG | CAU | H12 | 13.9° | 150.0° |
| CAH | NAG | CAU | H13 | 133.5° | 30.0° |
| CAI | CAF | CAE | NAG | 0.5° | 0.2° |
| CAI | CAF | CAE | CAA | 179.0° | 179.4° |
| CAI | CAF | CAE | CAD | 179.2° | 180.0° |
| CAI | CAF | CAA | OAJ | 0.4° | 0.5° |
| CAI | CAF | CAA | CAB | 178.6° | 179.8° |
| NAG | CAU | CAV | H12 | 120.2° | 120.0° |
| NAG | CAU | CAV | H13 | 120.2° | 120.1° |
| CAU | NAG | CAE | CAF | 178.5° | 180.0° |
| CAU | NAG | CAE | CAD | 1.8° | 0.2° |
| NAG | CAU | CAV | CBA | 145.5° | 89.9° |
| NAG | CAU | CAV | CAW | 34.1° | 90.3° |
| NAG | CAU | H12 | H13 | 119.3° | 120.0° |
| CAE | NAG | CAU | CAV | 72.1° | 89.6° |
| NAG | CAE | CAF | CAD | 179.7° | 179.8° |
| NAG | CAE | CAF | CAA | 179.6° | 179.6° |
| NAG | CAE | CAD | CAC | 179.7° | 180.0° |
| NAG | CAE | CAD | H6 | 0.3° | 0.0° |
| CAE | NAG | CAU | H12 | 167.7° | 30.4° |
| CAE | NAG | CAU | H13 | 48.1° | 150.4° |
| CAU | CAV | CBA | CAW | 179.7° | 179.8° |
| CAU | CAV | CBA | CAZ | 179.9° | 180.0° |
| CAU | CAV | CAW | CAX | 179.5° | 179.7° |
| CAV | CAU | H12 | H13 | 119.3° | 120.0° |
| CAU | CAV | CBA | H14 | 0.1° | 0.1° |
| CAU | CAV | CAW | H17 | 0.5° | 0.0° |
| CAE | CAF | CAA | OAJ | 179.1° | 179.6° |
| CAE | CAF | CAA | CAB | 0.1° | 0.6° |
| CAF | CAE | CAD | CAC | 0.0° | 0.3° |
| CAF | CAE | CAD | H6 | 180.0° | 179.6° |
| CAA | CAF | CAE | CAD | 0.2° | 0.6° |
| CAF | CAA | OAJ | CAB | 179.0° | 179.7° |
| CAF | CAA | OAJ | CAK | 138.8° | 179.7° |
| CAF | CAA | CAB | CAC | 0.5° | 0.3° |
| CAF | CAA | CAB | H4 | 179.5° | 179.7° |
| CAE | CAD | CAC | H6 | 180.0° | 180.0° |
| CAE | CAD | CAC | CAB | 0.5° | 0.0° |
| CAE | CAD | CAC | H5 | 179.5° | 180.0° |
| CAA | OAJ | CAK | CAL | 118.5° | 180.0° |
| OAJ | CAA | CAB | CAC | 179.5° | 179.9° |
| CAA | OAJ | CAK | H2 | 121.1° | 60.0° |
| CAA | OAJ | CAK | H3 | 1.9° | 59.9° |
| OAJ | CAA | CAB | H4 | 0.5° | 0.0° |
| OAJ | CAK | CAL | OAM | 19.3° | 0.0° |
| CAK | OAJ | CAA | CAB | 42.2° | 0.0° |
| OAJ | CAK | CAL | H2 | 120.4° | 120.0° |
| OAJ | CAK | CAL | H3 | 120.4° | 120.0° |
| OAJ | CAK | CAL | OAN | 158.8° | 179.8° |
| OAJ | CAK | H2 | H3 | 118.8° | 119.9° |
| OAM | CAL | CAK | OAN | 178.1° | 179.8° |
| OAM | CAL | OAN | H1 | 0.0° | 0.1° |
| OAM | CAL | CAK | H2 | 139.7° | 120.0° |
| OAM | CAL | CAK | H3 | 101.1° | 120.0° |
| CAA | CAB | CAC | CAD | 0.7° | 0.0° |
| CAA | CAB | CAC | H4 | 180.0° | 179.9° |
| CAA | CAB | CAC | H5 | 179.3° | 180.0° |
| CAV | CBA | CAZ | H14 | 180.0° | 180.0° |
| CBA | CAV | CAW | CAX | 0.1° | 0.5° |
| CAV | CBA | CAZ | CAY | 0.3° | 0.1° |
| CAV | CBA | CAZ | BRB | 179.9° | 179.9° |
| CBA | CAV | CAU | H12 | 94.2° | 30.1° |
| CBA | CAV | CAU | H13 | 25.3° | 150.0° |
| CBA | CAV | CAW | H17 | 179.9° | 179.8° |
| CAW | CAV | CBA | CAZ | 0.2° | 0.2° |
| CAV | CAW | CAX | H17 | 180.0° | 179.7° |
| CAV | CAW | CAX | CAY | 0.4° | 0.6° |
| CAW | CAV | CAU | H12 | 86.1° | 149.7° |
| CAW | CAV | CAU | H13 | 154.3° | 29.8° |
| CAW | CAV | CBA | H14 | 179.8° | 179.7° |
| CAV | CAW | CAX | H16 | 179.6° | 179.7° |
| CAD | CAC | CAB | H5 | 180.0° | 180.0° |
| CAD | CAC | CAB | H4 | 179.3° | 179.9° |
| CBA | CAZ | CAY | BRB | 179.6° | 180.0° |
| CBA | CAZ | CAY | CAX | 0.0° | 0.0° |
| CBA | CAZ | CAY | H15 | 179.9° | 180.0° |
| CAW | CAX | CAY | CAZ | 0.4° | 0.3° |
| CAW | CAX | CAY | H16 | 180.0° | 179.7° |
| CAW | CAX | CAY | H15 | 179.6° | 179.7° |
| CAK | CAL | OAN | H1 | 177.9° | 179.7° |
| CAL | CAK | H2 | H3 | 118.8° | 120.0° |
| OAN | CAL | CAK | H2 | 38.4° | 60.2° |
| OAN | CAL | CAK | H3 | 80.8° | 59.7° |
| CAB | CAC | CAD | H6 | 179.5° | 180.0° |
| CAZ | CAY | CAX | H15 | 180.0° | 180.0° |
| CAY | CAZ | CBA | H14 | 179.8° | 180.0° |
| CAZ | CAY | CAX | H16 | 179.6° | 180.0° |
| BRB | CAZ | CAY | CAX | 179.6° | 180.0° |
| BRB | CAZ | CBA | H14 | 0.1° | 0.0° |
| BRB | CAZ | CAY | H15 | 0.4° | 0.1° |
| CAY | CAX | CAW | H17 | 179.6° | 179.7° |
| H4 | CAB | CAC | H5 | 0.7° | 0.1° |
| H5 | CAC | CAD | H6 | 0.5° | 0.0° |
| H9 | CAT | H10 | H11 | 120.0° | 120.0° |
| H15 | CAY | CAX | H16 | 0.4° | 0.0° |
| H16 | CAX | CAW | H17 | 0.4° | 0.0° |
