U7Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAG | CAH | doub | 1.38Å | 1.39Å | Aromatic |
| CAG | CAI | sing | 1.38Å | 1.39Å | Aromatic |
| CAH | CAN | sing | 1.38Å | 1.39Å | Aromatic |
| CAI | CAU | doub | 1.38Å | 1.39Å | Aromatic |
| CAN | CAX | doub | 1.40Å | 1.39Å | Aromatic |
| CAU | CAX | sing | 1.40Å | 1.39Å | Aromatic |
| CAU | CL | sing | 1.74Å | 1.72Å | |
| CAX | CAT | sing | 1.48Å | 1.50Å | |
| CAQ | CAO | sing | 1.53Å | 1.53Å | |
| CAQ | NAZ | sing | 1.47Å | 1.48Å | |
| CAT | NAZ | sing | 1.35Å | 1.34Å | |
| CAT | OAC | doub | 1.22Å | 1.23Å | |
| CAO | NAY | sing | 1.47Å | 1.48Å | |
| NAZ | CAR | sing | 1.47Å | 1.48Å | |
| OAB | CAS | doub | 1.22Å | 1.23Å | |
| NAY | CAS | sing | 1.35Å | 1.34Å | |
| NAY | CAP | sing | 1.47Å | 1.48Å | |
| CAR | CAP | sing | 1.53Å | 1.53Å | |
| CAS | CAV | sing | 1.48Å | 1.50Å | |
| CAK | CAV | doub | 1.40Å | 1.39Å | Aromatic |
| CAK | CAM | sing | 1.38Å | 1.39Å | Aromatic |
| CAV | CAJ | sing | 1.40Å | 1.39Å | Aromatic |
| CAM | CAW | doub | 1.38Å | 1.39Å | Aromatic |
| CAJ | CAL | doub | 1.38Å | 1.39Å | Aromatic |
| CAW | CAL | sing | 1.38Å | 1.39Å | Aromatic |
| CAW | SBA | sing | 1.76Å | 1.75Å | |
| OAE | SBA | doub | 1.42Å | 1.43Å | |
| SBA | OAD | doub | 1.42Å | 1.43Å | |
| SBA | NAA | sing | 1.66Å | 1.63Å | |
| CAI | H1 | sing | 1.08Å | 1.08Å | |
| CAG | H2 | sing | 1.08Å | 1.08Å | |
| CAH | H3 | sing | 1.08Å | 1.08Å | |
| CAN | H4 | sing | 1.08Å | 1.08Å | |
| CAR | H5 | sing | 1.09Å | 1.10Å | |
| CAR | H6 | sing | 1.09Å | 1.10Å | |
| CAP | H7 | sing | 1.09Å | 1.10Å | |
| CAP | H8 | sing | 1.09Å | 1.10Å | |
| CAQ | H9 | sing | 1.09Å | 1.10Å | |
| CAQ | H10 | sing | 1.09Å | 1.10Å | |
| CAO | H11 | sing | 1.09Å | 1.10Å | |
| CAO | H12 | sing | 1.09Å | 1.10Å | |
| CAJ | H13 | sing | 1.08Å | 1.08Å | |
| CAL | H14 | sing | 1.08Å | 1.08Å | |
| NAA | H15 | sing | 0.97Å | 1.00Å | |
| NAA | H16 | sing | 0.97Å | 1.00Å | |
| CAM | H17 | sing | 1.08Å | 1.08Å | |
| CAK | H18 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAH | CAG | CAI | 119.9° | 120.3° |
| CAG | CAH | CAN | 119.9° | 120.2° |
| CAH | CAG | H2 | 120.0° | 119.9° |
| CAG | CAH | H3 | 120.0° | 119.9° |
| CAG | CAI | CAU | 120.1° | 120.1° |
| CAG | CAI | H1 | 119.9° | 119.9° |
| CAI | CAG | H2 | 120.0° | 119.8° |
| CAH | CAN | CAX | 120.3° | 119.9° |
| CAN | CAH | H3 | 120.1° | 119.9° |
| CAH | CAN | H4 | 119.9° | 120.0° |
| CAI | CAU | CAX | 120.1° | 119.8° |
| CAI | CAU | CL | 119.2° | 120.1° |
| CAU | CAI | H1 | 119.9° | 119.9° |
| CAN | CAX | CAU | 119.7° | 119.7° |
| CAN | CAX | CAT | 119.8° | 120.2° |
| CAX | CAN | H4 | 119.8° | 120.1° |
| CAX | CAU | CL | 119.9° | 120.1° |
| CAU | CAX | CAT | 120.0° | 120.2° |
| CAX | CAT | NAZ | 119.2° | 120.0° |
| CAX | CAT | OAC | 118.9° | 120.0° |
| CAO | CAQ | NAZ | 112.1° | 108.7° |
| CAQ | CAO | NAY | 110.4° | 108.7° |
| CAO | CAQ | H9 | 108.8° | 109.6° |
| CAO | CAQ | H10 | 108.8° | 109.6° |
| CAQ | CAO | H11 | 109.2° | 109.6° |
| CAQ | CAO | H12 | 109.2° | 109.7° |
| CAQ | NAZ | CAT | 122.6° | 120.6° |
| CAQ | NAZ | CAR | 114.4° | 118.8° |
| NAZ | CAQ | H9 | 108.8° | 109.6° |
| NAZ | CAQ | H10 | 108.8° | 109.7° |
| NAZ | CAT | OAC | 121.8° | 120.0° |
| CAT | NAZ | CAR | 122.2° | 120.6° |
| CAO | NAY | CAS | 123.7° | 120.6° |
| CAO | NAY | CAP | 112.9° | 118.7° |
| NAY | CAO | H11 | 109.2° | 109.6° |
| NAY | CAO | H12 | 109.2° | 109.5° |
| NAZ | CAR | CAP | 110.9° | 108.7° |
| NAZ | CAR | H5 | 109.1° | 109.6° |
| NAZ | CAR | H6 | 109.1° | 109.6° |
| OAB | CAS | NAY | 121.8° | 120.1° |
| OAB | CAS | CAV | 119.0° | 120.0° |
| CAS | NAY | CAP | 123.1° | 120.7° |
| NAY | CAS | CAV | 118.5° | 120.0° |
| NAY | CAP | CAR | 109.4° | 108.6° |
| NAY | CAP | H7 | 109.5° | 109.6° |
| NAY | CAP | H8 | 109.5° | 109.8° |
| CAP | CAR | H5 | 109.1° | 109.6° |
| CAP | CAR | H6 | 109.1° | 109.6° |
| CAR | CAP | H7 | 109.5° | 109.6° |
| CAR | CAP | H8 | 109.5° | 109.6° |
| CAS | CAV | CAK | 119.1° | 120.2° |
| CAS | CAV | CAJ | 120.8° | 120.1° |
| CAV | CAK | CAM | 120.6° | 119.9° |
| CAK | CAV | CAJ | 118.8° | 119.7° |
| CAV | CAK | H18 | 119.7° | 120.1° |
| CAK | CAM | CAW | 120.2° | 120.1° |
| CAK | CAM | H17 | 119.9° | 119.9° |
| CAM | CAK | H18 | 119.7° | 120.1° |
| CAV | CAJ | CAL | 120.8° | 119.8° |
| CAV | CAJ | H13 | 119.6° | 120.1° |
| CAM | CAW | CAL | 119.5° | 120.3° |
| CAM | CAW | SBA | 118.6° | 119.8° |
| CAW | CAM | H17 | 119.9° | 119.9° |
| CAJ | CAL | CAW | 119.9° | 120.1° |
| CAL | CAJ | H13 | 119.6° | 120.1° |
| CAJ | CAL | H14 | 120.0° | 119.9° |
| CAL | CAW | SBA | 121.6° | 119.8° |
| CAW | CAL | H14 | 120.1° | 119.9° |
| CAW | SBA | OAE | 107.0° | 106.4° |
| CAW | SBA | OAD | 107.2° | 106.4° |
| CAW | SBA | NAA | 109.7° | 107.2° |
| OAE | SBA | OAD | 116.9° | 123.2° |
| OAE | SBA | NAA | 108.4° | 106.4° |
| OAD | SBA | NAA | 107.5° | 106.4° |
| SBA | NAA | H15 | 109.5° | 120.0° |
| SBA | NAA | H16 | 109.4° | 120.0° |
| H5 | CAR | H6 | 109.5° | 109.7° |
| H7 | CAP | H8 | 109.5° | 109.6° |
| H9 | CAQ | H10 | 109.5° | 109.7° |
| H11 | CAO | H12 | 109.5° | 109.8° |
| H15 | NAA | H16 | 109.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAH | CAG | CAI | H2 | 180.0° | 180.0° |
| CAG | CAH | CAN | H3 | 180.0° | 179.9° |
| CAH | CAG | CAI | CAU | 0.8° | 0.0° |
| CAG | CAH | CAN | CAX | 1.1° | 0.0° |
| CAH | CAG | CAI | H1 | 179.2° | 180.0° |
| CAG | CAH | CAN | H4 | 178.9° | 180.0° |
| CAI | CAG | CAH | CAN | 0.1° | 0.0° |
| CAG | CAI | CAU | H1 | 180.0° | 180.0° |
| CAG | CAI | CAU | CAX | 0.8° | 0.1° |
| CAG | CAI | CAU | CL | 168.9° | 179.8° |
| CAI | CAG | CAH | H3 | 179.9° | 180.0° |
| CAH | CAN | CAX | H4 | 180.0° | 180.0° |
| CAH | CAN | CAX | CAU | 1.1° | 0.1° |
| CAH | CAN | CAX | CAT | 170.4° | 179.7° |
| CAN | CAH | CAG | H2 | 179.9° | 180.0° |
| CAI | CAU | CAX | CAN | 0.2° | 0.1° |
| CAI | CAU | CAX | CL | 169.6° | 179.8° |
| CAI | CAU | CAX | CAT | 171.3° | 179.7° |
| CAU | CAI | CAG | H2 | 179.2° | 180.0° |
| CAN | CAX | CAU | CAT | 171.5° | 179.7° |
| CAN | CAX | CAU | CL | 169.7° | 179.7° |
| CAN | CAX | CAT | NAZ | 110.1° | 53.0° |
| CAN | CAX | CAT | OAC | 66.7° | 127.0° |
| CAX | CAN | CAH | H3 | 178.9° | 179.9° |
| CAU | CAX | CAT | NAZ | 78.4° | 126.7° |
| CAU | CAX | CAT | OAC | 104.8° | 53.4° |
| CAX | CAU | CAI | H1 | 179.2° | 180.0° |
| CAU | CAX | CAN | H4 | 178.9° | 180.0° |
| CL | CAU | CAX | CAT | 1.7° | 0.1° |
| CL | CAU | CAI | H1 | 11.2° | 0.2° |
| CAX | CAT | NAZ | CAQ | 0.6° | 175.0° |
| CAX | CAT | NAZ | OAC | 176.7° | 180.0° |
| CAX | CAT | NAZ | CAR | 170.0° | 5.4° |
| CAT | CAX | CAN | H4 | 9.6° | 0.3° |
| CAO | CAQ | NAZ | H9 | 120.4° | 119.7° |
| CAO | CAQ | NAZ | H10 | 120.4° | 119.8° |
| CAO | CAQ | NAZ | CAT | 139.9° | 124.7° |
| CAQ | CAO | NAY | H11 | 120.1° | 119.8° |
| CAQ | CAO | NAY | H12 | 120.1° | 119.8° |
| CAO | CAQ | NAZ | CAR | 50.0° | 54.9° |
| CAQ | CAO | NAY | CAS | 128.3° | 124.8° |
| CAQ | CAO | NAY | CAP | 56.6° | 55.5° |
| CAO | CAQ | H9 | H10 | 118.8° | 120.4° |
| CAQ | CAO | H11 | H12 | 119.6° | 120.5° |
| CAQ | NAZ | CAT | CAR | 169.3° | 179.7° |
| CAQ | NAZ | CAT | OAC | 176.0° | 5.0° |
| NAZ | CAQ | CAO | NAY | 50.4° | 49.5° |
| CAQ | NAZ | CAR | CAP | 52.4° | 55.0° |
| CAQ | NAZ | CAR | H5 | 172.6° | 64.8° |
| CAQ | NAZ | CAR | H6 | 67.8° | 174.7° |
| NAZ | CAQ | H9 | H10 | 118.8° | 120.5° |
| NAZ | CAQ | CAO | H11 | 170.6° | 70.3° |
| NAZ | CAQ | CAO | H12 | 69.7° | 169.2° |
| CAT | NAZ | CAR | CAP | 137.5° | 124.7° |
| CAT | NAZ | CAR | H5 | 17.2° | 115.5° |
| CAT | NAZ | CAR | H6 | 102.3° | 5.0° |
| CAT | NAZ | CAQ | H9 | 19.4° | 5.0° |
| CAT | NAZ | CAQ | H10 | 99.8° | 115.5° |
| OAC | CAT | NAZ | CAR | 6.7° | 174.7° |
| CAO | NAY | CAS | OAB | 16.3° | 175.7° |
| CAO | NAY | CAS | CAP | 174.6° | 179.7° |
| CAO | NAY | CAP | CAR | 59.0° | 55.5° |
| CAO | NAY | CAS | CAV | 173.9° | 4.4° |
| CAO | NAY | CAP | H7 | 179.0° | 175.2° |
| CAO | NAY | CAP | H8 | 61.0° | 64.3° |
| NAY | CAO | CAQ | H9 | 170.9° | 169.2° |
| NAY | CAO | CAQ | H10 | 70.0° | 70.3° |
| NAY | CAO | H11 | H12 | 119.6° | 120.3° |
| NAZ | CAR | CAP | NAY | 55.2° | 49.4° |
| NAZ | CAR | CAP | H5 | 120.2° | 119.8° |
| NAZ | CAR | CAP | H6 | 120.2° | 119.7° |
| NAZ | CAR | H5 | H6 | 119.4° | 120.4° |
| NAZ | CAR | CAP | H7 | 175.2° | 169.2° |
| NAZ | CAR | CAP | H8 | 64.8° | 70.5° |
| CAR | NAZ | CAQ | H9 | 170.4° | 174.7° |
| CAR | NAZ | CAQ | H10 | 70.3° | 64.9° |
| OAB | CAS | NAY | CAV | 169.8° | 179.9° |
| OAB | CAS | NAY | CAP | 169.0° | 4.0° |
| OAB | CAS | CAV | CAK | 39.1° | 133.6° |
| OAB | CAS | CAV | CAJ | 127.8° | 46.2° |
| CAS | NAY | CAP | CAR | 125.8° | 124.8° |
| NAY | CAS | CAV | CAK | 130.9° | 46.5° |
| NAY | CAS | CAV | CAJ | 62.1° | 133.7° |
| CAS | NAY | CAP | H7 | 5.8° | 5.1° |
| CAS | NAY | CAP | H8 | 114.2° | 115.3° |
| CAS | NAY | CAO | H11 | 8.2° | 115.4° |
| CAS | NAY | CAO | H12 | 111.6° | 5.1° |
| NAY | CAP | CAR | H7 | 120.0° | 119.7° |
| NAY | CAP | CAR | H8 | 120.0° | 119.9° |
| CAP | NAY | CAS | CAV | 0.7° | 175.9° |
| NAY | CAP | CAR | H5 | 175.4° | 70.4° |
| NAY | CAP | CAR | H6 | 65.0° | 169.2° |
| NAY | CAP | H7 | H8 | 120.0° | 120.5° |
| CAP | NAY | CAO | H11 | 176.7° | 64.3° |
| CAP | NAY | CAO | H12 | 63.5° | 175.3° |
| CAP | CAR | H5 | H6 | 119.3° | 120.4° |
| CAR | CAP | H7 | H8 | 120.0° | 120.4° |
| CAS | CAV | CAK | CAJ | 167.2° | 179.8° |
| CAS | CAV | CAK | CAM | 165.9° | 179.7° |
| CAS | CAV | CAJ | CAL | 166.3° | 179.9° |
| CAS | CAV | CAJ | H13 | 13.7° | 0.0° |
| CAS | CAV | CAK | H18 | 14.1° | 0.0° |
| CAV | CAK | CAM | H18 | 180.0° | 179.8° |
| CAV | CAK | CAM | CAW | 0.3° | 0.5° |
| CAK | CAV | CAJ | CAL | 0.6° | 0.1° |
| CAK | CAV | CAJ | H13 | 179.4° | 179.8° |
| CAV | CAK | CAM | H17 | 179.8° | 179.8° |
| CAM | CAK | CAV | CAJ | 1.3° | 0.5° |
| CAK | CAM | CAW | H17 | 180.0° | 179.7° |
| CAK | CAM | CAW | CAL | 1.4° | 0.2° |
| CAK | CAM | CAW | SBA | 175.7° | 179.7° |
| CAV | CAJ | CAL | H13 | 180.0° | 179.9° |
| CAV | CAJ | CAL | CAW | 1.0° | 0.1° |
| CAV | CAJ | CAL | H14 | 179.0° | 180.0° |
| CAJ | CAV | CAK | H18 | 178.7° | 179.7° |
| CAM | CAW | CAL | CAJ | 2.1° | 0.1° |
| CAM | CAW | CAL | SBA | 174.1° | 179.9° |
| CAM | CAW | SBA | OAE | 26.9° | 156.5° |
| CAM | CAW | SBA | OAD | 99.2° | 23.6° |
| CAM | CAW | SBA | NAA | 144.4° | 90.0° |
| CAM | CAW | CAL | H14 | 177.9° | 179.9° |
| CAW | CAM | CAK | H18 | 179.7° | 179.7° |
| CAJ | CAL | CAW | H14 | 180.0° | 179.8° |
| CAJ | CAL | CAW | SBA | 176.2° | 180.0° |
| CAL | CAW | SBA | OAE | 158.9° | 23.6° |
| CAL | CAW | SBA | OAD | 75.0° | 156.5° |
| CAL | CAW | SBA | NAA | 41.4° | 89.9° |
| CAW | CAL | CAJ | H13 | 179.0° | 180.0° |
| CAL | CAW | CAM | H17 | 178.6° | 179.9° |
| CAW | SBA | OAE | OAD | 120.1° | 122.9° |
| CAW | SBA | OAE | NAA | 118.3° | 114.1° |
| CAW | SBA | OAD | NAA | 117.9° | 114.1° |
| SBA | CAW | CAL | H14 | 3.8° | 0.1° |
| CAW | SBA | NAA | H15 | 180.0° | 150.0° |
| CAW | SBA | NAA | H16 | 60.0° | 30.0° |
| SBA | CAW | CAM | H17 | 4.3° | 0.0° |
| OAE | SBA | OAD | NAA | 122.1° | 123.0° |
| OAE | SBA | NAA | H15 | 63.4° | 96.4° |
| OAE | SBA | NAA | H16 | 56.6° | 83.6° |
| OAD | SBA | NAA | H15 | 63.8° | 36.5° |
| OAD | SBA | NAA | H16 | 176.3° | 143.5° |
| SBA | NAA | H15 | H16 | 120.0° | 180.0° |
| H1 | CAI | CAG | H2 | 0.8° | 0.0° |
| H2 | CAG | CAH | H3 | 0.1° | 0.1° |
| H3 | CAH | CAN | H4 | 1.1° | 0.0° |
| H5 | CAR | CAP | H7 | 64.6° | 49.4° |
| H5 | CAR | CAP | H8 | 55.5° | 169.7° |
| H6 | CAR | CAP | H7 | 55.0° | 71.1° |
| H6 | CAR | CAP | H8 | 175.0° | 49.2° |
| H9 | CAQ | CAO | H11 | 69.0° | 49.4° |
| H9 | CAQ | CAO | H12 | 50.8° | 71.1° |
| H10 | CAQ | CAO | H11 | 50.2° | 169.9° |
| H10 | CAQ | CAO | H12 | 169.9° | 49.3° |
| H13 | CAJ | CAL | H14 | 1.0° | 0.1° |
| H17 | CAM | CAK | H18 | 0.3° | 0.0° |
