07B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CBK | CAR | sing | 1.53Å | 1.55Å | |
| CBK | CBJ | sing | 1.53Å | 1.52Å | |
| CBK | OX0 | sing | 1.43Å | 1.46Å | |
| CAR | CBO | sing | 1.53Å | 1.53Å | |
| CBO | CBA | sing | 1.51Å | 1.53Å | |
| CBO | CBN | sing | 1.53Å | 1.53Å | |
| CBA | OAE | doub | 1.21Å | 1.23Å | |
| CBA | OAT | sing | 1.34Å | 1.36Å | |
| OAT | CAB | sing | 1.45Å | 1.45Å | |
| CBN | CAZ | sing | 1.51Å | 1.54Å | |
| CBN | CAQ | sing | 1.53Å | 1.53Å | |
| CAZ | OAD | doub | 1.21Å | 1.23Å | |
| CAZ | OAS | sing | 1.34Å | 1.37Å | |
| OAS | CAA | sing | 1.45Å | 1.46Å | |
| CAQ | CBJ | sing | 1.53Å | 1.52Å | |
| CBJ | OAV | sing | 1.43Å | 1.46Å | |
| CBK | HBK | sing | 1.09Å | 1.10Å | |
| CAR | HAR1 | sing | 1.09Å | 1.10Å | |
| CAR | HAR2 | sing | 1.09Å | 1.10Å | |
| CBJ | HBJ | sing | 1.09Å | 1.10Å | |
| OX0 | HX0 | sing | 0.97Å | 0.95Å | |
| CBO | HBO | sing | 1.09Å | 1.10Å | |
| CBN | HBN | sing | 1.09Å | 1.10Å | |
| CAB | HAB1 | sing | 1.09Å | 1.10Å | |
| CAB | HAB2 | sing | 1.09Å | 1.10Å | |
| CAB | HAB3 | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ1 | sing | 1.09Å | 1.10Å | |
| CAQ | HAQ2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| OAV | HAV | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAR | CBK | CBJ | 113.6° | 109.5° |
| CAR | CBK | OX0 | 106.0° | 109.5° |
| CBK | CAR | CBO | 109.0° | 109.5° |
| CAR | CBK | HBK | 107.9° | 109.5° |
| CBK | CAR | HAR1 | 109.6° | 109.5° |
| CBK | CAR | HAR2 | 109.8° | 109.5° |
| CBJ | CBK | OX0 | 105.5° | 109.5° |
| CBK | CBJ | CAQ | 111.4° | 109.5° |
| CBK | CBJ | OAV | 104.7° | 109.5° |
| CBJ | CBK | HBK | 108.3° | 109.4° |
| CBK | CBJ | HBJ | 112.2° | 109.4° |
| OX0 | CBK | HBK | 115.6° | 109.5° |
| CBK | OX0 | HX0 | 109.5° | 114.0° |
| CAR | CBO | CBA | 108.8° | 109.5° |
| CAR | CBO | CBN | 111.6° | 109.5° |
| CBO | CAR | HAR1 | 109.7° | 109.5° |
| CBO | CAR | HAR2 | 109.8° | 109.5° |
| CAR | CBO | HBO | 109.0° | 109.5° |
| CBA | CBO | CBN | 111.0° | 109.5° |
| CBO | CBA | OAE | 120.6° | 120.0° |
| CBO | CBA | OAT | 119.4° | 120.0° |
| CBA | CBO | HBO | 109.6° | 109.4° |
| CBO | CBN | CAZ | 110.7° | 109.5° |
| CBO | CBN | CAQ | 110.2° | 109.5° |
| CBN | CBO | HBO | 106.7° | 109.5° |
| CBO | CBN | HBN | 108.7° | 109.5° |
| OAE | CBA | OAT | 120.0° | 120.0° |
| CBA | OAT | CAB | 107.4° | 117.0° |
| OAT | CAB | HAB1 | 109.5° | 109.5° |
| OAT | CAB | HAB2 | 109.5° | 109.5° |
| OAT | CAB | HAB3 | 109.5° | 109.4° |
| CAZ | CBN | CAQ | 111.3° | 109.5° |
| CBN | CAZ | OAD | 119.3° | 120.0° |
| CBN | CAZ | OAS | 121.4° | 120.0° |
| CAZ | CBN | HBN | 107.6° | 109.4° |
| CBN | CAQ | CBJ | 107.6° | 109.5° |
| CAQ | CBN | HBN | 108.2° | 109.5° |
| CBN | CAQ | HAQ1 | 110.1° | 109.5° |
| CBN | CAQ | HAQ2 | 110.5° | 109.5° |
| OAD | CAZ | OAS | 119.3° | 120.0° |
| CAZ | OAS | CAA | 111.2° | 117.0° |
| OAS | CAA | HAA1 | 109.5° | 109.4° |
| OAS | CAA | HAA2 | 109.5° | 109.5° |
| OAS | CAA | HAA3 | 109.4° | 109.5° |
| CAQ | CBJ | OAV | 112.0° | 109.5° |
| CAQ | CBJ | HBJ | 104.9° | 109.5° |
| CBJ | CAQ | HAQ1 | 110.1° | 109.5° |
| CBJ | CAQ | HAQ2 | 110.5° | 109.5° |
| OAV | CBJ | HBJ | 111.7° | 109.5° |
| CBJ | OAV | HAV | 109.5° | 114.0° |
| HAR1 | CAR | HAR2 | 109.1° | 109.5° |
| HAB1 | CAB | HAB2 | 109.4° | 109.5° |
| HAB1 | CAB | HAB3 | 109.5° | 109.5° |
| HAB2 | CAB | HAB3 | 109.5° | 109.5° |
| HAQ1 | CAQ | HAQ2 | 108.1° | 109.5° |
| HAA1 | CAA | HAA2 | 109.5° | 109.5° |
| HAA1 | CAA | HAA3 | 109.4° | 109.5° |
| HAA2 | CAA | HAA3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAR | CBK | CBJ | OX0 | 115.8° | 120.0° |
| CAR | CBK | CBJ | HBK | 119.8° | 120.0° |
| CAR | CBK | OX0 | HBK | 119.5° | 120.0° |
| CBK | CAR | CBO | HAR1 | 120.0° | 120.0° |
| CBK | CAR | CBO | HAR2 | 120.2° | 120.0° |
| CBK | CAR | CBO | CBA | 176.1° | 180.0° |
| CBK | CAR | CBO | CBN | 53.2° | 60.0° |
| CAR | CBK | CBJ | CAQ | 55.5° | 60.0° |
| CAR | CBK | CBJ | OAV | 65.8° | 60.0° |
| CBK | CAR | HAR1 | HAR2 | 120.2° | 120.0° |
| CAR | CBK | CBJ | HBJ | 172.9° | 180.0° |
| CAR | CBK | OX0 | HX0 | 56.3° | 180.0° |
| CBK | CAR | CBO | HBO | 64.4° | 60.0° |
| CBJ | CBK | OX0 | HBK | 119.7° | 120.0° |
| CBJ | CBK | CAR | CBO | 50.9° | 60.0° |
| CBK | CBJ | CAQ | CBN | 59.2° | 60.0° |
| CBK | CBJ | CAQ | OAV | 116.9° | 120.0° |
| CBK | CBJ | CAQ | HBJ | 121.7° | 120.0° |
| CBK | CBJ | OAV | HBJ | 121.7° | 120.0° |
| CBJ | CBK | CAR | HAR1 | 69.1° | 59.9° |
| CBJ | CBK | CAR | HAR2 | 171.1° | 179.9° |
| CBJ | CBK | OX0 | HX0 | 177.2° | 60.0° |
| CBK | CBJ | CAQ | HAQ1 | 179.2° | 179.9° |
| CBK | CBJ | CAQ | HAQ2 | 61.5° | 59.9° |
| CBK | CBJ | OAV | HAV | 176.8° | 60.0° |
| OX0 | CBK | CAR | CBO | 64.6° | 60.0° |
| OX0 | CBK | CBJ | CAQ | 60.3° | 60.0° |
| OX0 | CBK | CBJ | OAV | 178.4° | 180.0° |
| OX0 | CBK | CAR | HAR1 | 175.4° | 180.0° |
| OX0 | CBK | CAR | HAR2 | 55.6° | 60.0° |
| OX0 | CBK | CBJ | HBJ | 57.1° | 60.0° |
| CAR | CBO | CBA | CBN | 123.2° | 120.0° |
| CAR | CBO | CBA | HBO | 119.2° | 120.0° |
| CAR | CBO | CBN | HBO | 119.0° | 120.0° |
| CAR | CBO | CBA | OAE | 171.2° | 120.0° |
| CAR | CBO | CBA | OAT | 8.0° | 59.9° |
| CAR | CBO | CBN | CAZ | 175.5° | 180.0° |
| CAR | CBO | CBN | CAQ | 60.9° | 60.0° |
| CBO | CAR | CBK | HBK | 171.0° | 180.0° |
| CBO | CAR | HAR1 | HAR2 | 120.2° | 120.0° |
| CAR | CBO | CBN | HBN | 57.5° | 60.0° |
| CBA | CBO | CBN | HBO | 119.4° | 120.0° |
| CBO | CBA | OAE | OAT | 179.2° | 179.9° |
| CBO | CBA | OAT | CAB | 91.4° | 180.0° |
| CBA | CBO | CBN | CAZ | 53.9° | 60.0° |
| CBA | CBO | CBN | CAQ | 177.5° | 180.0° |
| CBA | CBO | CAR | HAR1 | 56.1° | 60.0° |
| CBA | CBO | CAR | HAR2 | 63.7° | 60.0° |
| CBA | CBO | CBN | HBN | 64.1° | 60.0° |
| CBN | CBO | CBA | OAE | 65.6° | 0.0° |
| CBN | CBO | CBA | OAT | 115.2° | 179.9° |
| CBO | CBN | CAZ | CAQ | 123.0° | 120.0° |
| CBO | CBN | CAZ | HBN | 118.7° | 120.1° |
| CBO | CBN | CAQ | HBN | 118.7° | 120.1° |
| CBO | CBN | CAZ | OAD | 66.8° | 0.0° |
| CBO | CBN | CAZ | OAS | 111.9° | 179.9° |
| CBO | CBN | CAQ | CBJ | 62.0° | 60.0° |
| CBN | CBO | CAR | HAR1 | 66.8° | 59.9° |
| CBN | CBO | CAR | HAR2 | 173.4° | 179.9° |
| CBO | CBN | CAQ | HAQ1 | 178.0° | 179.9° |
| CBO | CBN | CAQ | HAQ2 | 58.7° | 59.9° |
| OAE | CBA | OAT | CAB | 89.4° | 0.1° |
| OAE | CBA | CBO | HBO | 52.1° | 120.0° |
| OAT | CBA | CBO | HBO | 127.1° | 60.0° |
| CBA | OAT | CAB | HAB1 | 9.9° | 60.0° |
| CBA | OAT | CAB | HAB2 | 129.9° | 60.0° |
| CBA | OAT | CAB | HAB3 | 110.1° | 180.0° |
| OAT | CAB | HAB1 | HAB2 | 120.0° | 120.0° |
| OAT | CAB | HAB1 | HAB3 | 120.0° | 120.0° |
| OAT | CAB | HAB2 | HAB3 | 120.0° | 120.0° |
| CAZ | CBN | CAQ | HBN | 118.0° | 120.0° |
| CBN | CAZ | OAD | OAS | 178.8° | 179.9° |
| CBN | CAZ | OAS | CAA | 118.4° | 180.0° |
| CAZ | CBN | CAQ | CBJ | 174.7° | 180.0° |
| CAZ | CBN | CBO | HBO | 65.5° | 60.0° |
| CAZ | CBN | CAQ | HAQ1 | 54.7° | 60.0° |
| CAZ | CBN | CAQ | HAQ2 | 64.6° | 60.0° |
| CAQ | CBN | CAZ | OAD | 170.2° | 120.0° |
| CAQ | CBN | CAZ | OAS | 11.0° | 59.9° |
| CBN | CAQ | CBJ | HAQ1 | 120.0° | 120.0° |
| CBN | CAQ | CBJ | HAQ2 | 120.7° | 120.0° |
| CBN | CAQ | CBJ | OAV | 57.7° | 60.0° |
| CBN | CAQ | CBJ | HBJ | 179.1° | 180.0° |
| CAQ | CBN | CBO | HBO | 58.1° | 60.0° |
| CBN | CAQ | HAQ1 | HAQ2 | 120.7° | 120.0° |
| OAD | CAZ | OAS | CAA | 62.9° | 0.1° |
| OAD | CAZ | CBN | HBN | 51.9° | 120.0° |
| OAS | CAZ | CBN | HBN | 129.4° | 60.0° |
| CAZ | OAS | CAA | HAA1 | 177.3° | 180.0° |
| CAZ | OAS | CAA | HAA2 | 62.6° | 60.0° |
| CAZ | OAS | CAA | HAA3 | 57.4° | 60.0° |
| OAS | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
| OAS | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
| OAS | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| CAQ | CBJ | OAV | HBJ | 117.4° | 120.0° |
| CAQ | CBJ | CBK | HBK | 175.3° | 180.0° |
| CBJ | CAQ | CBN | HBN | 56.7° | 60.0° |
| CBJ | CAQ | HAQ1 | HAQ2 | 120.8° | 120.0° |
| CAQ | CBJ | OAV | HAV | 62.3° | 180.0° |
| OAV | CBJ | CBK | HBK | 54.0° | 60.0° |
| OAV | CBJ | CAQ | HAQ1 | 62.2° | 60.0° |
| OAV | CBJ | CAQ | HAQ2 | 178.4° | 180.0° |
| HBK | CBK | CAR | HAR1 | 51.0° | 60.0° |
| HBK | CBK | CAR | HAR2 | 68.8° | 60.0° |
| HBK | CBK | CBJ | HBJ | 67.3° | 60.0° |
| HBK | CBK | OX0 | HX0 | 63.1° | 60.0° |
| HAR1 | CAR | CBO | HBO | 175.6° | 180.0° |
| HAR2 | CAR | CBO | HBO | 55.8° | 60.0° |
| HBJ | CBJ | CAQ | HAQ1 | 59.1° | 60.0° |
| HBJ | CBJ | CAQ | HAQ2 | 60.2° | 60.0° |
| HBJ | CBJ | OAV | HAV | 55.1° | 60.0° |
| HBO | CBO | CBN | HBN | 176.5° | 180.0° |
| HBN | CBN | CAQ | HAQ1 | 63.3° | 60.0° |
| HBN | CBN | CAQ | HAQ2 | 177.4° | 180.0° |
| HAB1 | CAB | HAB2 | HAB3 | 120.0° | 120.0° |
| HAA1 | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
