ZZI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAB | sing | 1.53Å | 1.54Å | |
| CAB | CAC | sing | 1.53Å | 1.55Å | |
| CAC | NAH | sing | 1.46Å | 1.48Å | |
| NAH | CAG | sing | 1.47Å | 1.46Å | |
| NAH | CAI | sing | 1.35Å | 1.34Å | |
| CAG | CAF | sing | 1.53Å | 1.52Å | |
| CAF | CAE | sing | 1.53Å | 1.52Å | |
| CAI | OAD | doub | 1.21Å | 1.23Å | |
| CAI | CAJ | sing | 1.51Å | 1.55Å | |
| CAJ | OAN | sing | 1.43Å | 1.44Å | |
| CAJ | CAK | sing | 1.53Å | 1.53Å | |
| CAK | OAO | sing | 1.43Å | 1.43Å | |
| CAK | CAL | sing | 1.53Å | 1.53Å | |
| CAL | OAM | sing | 1.43Å | 1.43Å | |
| CAA | HAA1 | sing | 1.09Å | 1.10Å | |
| CAA | HAA2 | sing | 1.09Å | 1.10Å | |
| CAA | HAA3 | sing | 1.09Å | 1.10Å | |
| CAB | HAB1 | sing | 1.09Å | 1.10Å | |
| CAB | HAB2 | sing | 1.09Å | 1.10Å | |
| CAC | HAC1 | sing | 1.09Å | 1.10Å | |
| CAC | HAC2 | sing | 1.09Å | 1.10Å | |
| CAG | HAG1 | sing | 1.09Å | 1.10Å | |
| CAG | HAG2 | sing | 1.09Å | 1.10Å | |
| CAF | HAF1 | sing | 1.09Å | 1.10Å | |
| CAF | HAF2 | sing | 1.09Å | 1.10Å | |
| CAE | HAE1 | sing | 1.09Å | 1.10Å | |
| CAE | HAE2 | sing | 1.09Å | 1.10Å | |
| CAE | HAE3 | sing | 1.09Å | 1.10Å | |
| CAJ | HAJ | sing | 1.09Å | 1.10Å | |
| OAN | HAN | sing | 0.97Å | 0.95Å | |
| CAK | HAK | sing | 1.09Å | 1.10Å | |
| OAO | HAO | sing | 0.97Å | 0.95Å | |
| CAL | HAL1 | sing | 1.09Å | 1.10Å | |
| CAL | HAL2 | sing | 1.09Å | 1.10Å | |
| OAM | HAM | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CAB | CAC | 111.8° | 109.5° |
| CAB | CAA | HAA1 | 109.5° | 109.5° |
| CAB | CAA | HAA2 | 109.4° | 109.5° |
| CAB | CAA | HAA3 | 109.4° | 109.5° |
| CAA | CAB | HAB1 | 108.7° | 109.5° |
| CAA | CAB | HAB2 | 108.2° | 109.5° |
| CAB | CAC | NAH | 111.3° | 109.5° |
| CAC | CAB | HAB1 | 108.7° | 109.5° |
| CAC | CAB | HAB2 | 108.2° | 109.5° |
| CAB | CAC | HAC1 | 108.8° | 109.5° |
| CAB | CAC | HAC2 | 108.4° | 109.4° |
| CAC | NAH | CAG | 116.8° | 120.0° |
| CAC | NAH | CAI | 120.9° | 120.0° |
| NAH | CAC | HAC1 | 108.9° | 109.5° |
| NAH | CAC | HAC2 | 108.4° | 109.4° |
| CAG | NAH | CAI | 122.3° | 120.0° |
| NAH | CAG | CAF | 108.9° | 109.5° |
| NAH | CAG | HAG1 | 109.7° | 109.5° |
| NAH | CAG | HAG2 | 109.8° | 109.5° |
| NAH | CAI | OAD | 122.8° | 120.0° |
| NAH | CAI | CAJ | 117.3° | 120.0° |
| CAG | CAF | CAE | 109.1° | 109.5° |
| CAF | CAG | HAG1 | 109.7° | 109.4° |
| CAF | CAG | HAG2 | 109.8° | 109.5° |
| CAG | CAF | HAF1 | 109.6° | 109.5° |
| CAG | CAF | HAF2 | 109.7° | 109.5° |
| CAE | CAF | HAF1 | 109.6° | 109.5° |
| CAE | CAF | HAF2 | 109.7° | 109.5° |
| CAF | CAE | HAE1 | 109.5° | 109.5° |
| CAF | CAE | HAE2 | 109.5° | 109.5° |
| CAF | CAE | HAE3 | 109.5° | 109.5° |
| OAD | CAI | CAJ | 119.8° | 120.0° |
| CAI | CAJ | OAN | 111.8° | 109.5° |
| CAI | CAJ | CAK | 108.7° | 109.5° |
| CAI | CAJ | HAJ | 108.6° | 109.5° |
| OAN | CAJ | CAK | 110.2° | 109.4° |
| OAN | CAJ | HAJ | 107.1° | 109.5° |
| CAJ | OAN | HAN | 109.5° | 114.0° |
| CAJ | CAK | OAO | 107.1° | 109.4° |
| CAJ | CAK | CAL | 110.8° | 109.5° |
| CAK | CAJ | HAJ | 110.3° | 109.4° |
| CAJ | CAK | HAK | 110.3° | 109.5° |
| OAO | CAK | CAL | 109.8° | 109.5° |
| OAO | CAK | HAK | 111.2° | 109.4° |
| CAK | OAO | HAO | 109.5° | 114.0° |
| CAK | CAL | OAM | 109.0° | 109.4° |
| CAL | CAK | HAK | 107.6° | 109.5° |
| CAK | CAL | HAL1 | 109.6° | 109.5° |
| CAK | CAL | HAL2 | 109.7° | 109.5° |
| OAM | CAL | HAL1 | 109.6° | 109.5° |
| OAM | CAL | HAL2 | 109.7° | 109.5° |
| CAL | OAM | HAM | 109.5° | 114.0° |
| HAA1 | CAA | HAA2 | 109.5° | 109.5° |
| HAA1 | CAA | HAA3 | 109.5° | 109.4° |
| HAA2 | CAA | HAA3 | 109.5° | 109.4° |
| HAB1 | CAB | HAB2 | 111.3° | 109.4° |
| HAC1 | CAC | HAC2 | 111.0° | 109.5° |
| HAG1 | CAG | HAG2 | 109.0° | 109.4° |
| HAF1 | CAF | HAF2 | 109.2° | 109.5° |
| HAE1 | CAE | HAE2 | 109.4° | 109.5° |
| HAE1 | CAE | HAE3 | 109.5° | 109.5° |
| HAE2 | CAE | HAE3 | 109.5° | 109.5° |
| HAL1 | CAL | HAL2 | 109.1° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CAB | CAC | HAB1 | 120.0° | 120.0° |
| CAA | CAB | CAC | HAB2 | 119.1° | 120.0° |
| CAA | CAB | CAC | NAH | 133.8° | 180.0° |
| CAB | CAA | HAA1 | HAA2 | 120.0° | 120.0° |
| CAB | CAA | HAA1 | HAA3 | 120.0° | 120.0° |
| CAB | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| CAA | CAB | HAB1 | HAB2 | 119.1° | 120.0° |
| CAA | CAB | CAC | HAC1 | 106.2° | 60.0° |
| CAA | CAB | CAC | HAC2 | 14.6° | 60.0° |
| CAB | CAC | NAH | HAC1 | 120.0° | 120.0° |
| CAB | CAC | NAH | HAC2 | 119.2° | 120.0° |
| CAB | CAC | NAH | CAG | 114.0° | 90.0° |
| CAB | CAC | NAH | CAI | 65.2° | 90.0° |
| CAC | CAB | CAA | HAA1 | 114.8° | 180.0° |
| CAC | CAB | CAA | HAA2 | 5.2° | 60.0° |
| CAC | CAB | CAA | HAA3 | 125.2° | 60.0° |
| CAC | CAB | HAB1 | HAB2 | 119.1° | 120.0° |
| CAB | CAC | HAC1 | HAC2 | 119.2° | 120.0° |
| CAC | NAH | CAG | CAI | 179.1° | 180.0° |
| CAC | NAH | CAG | CAF | 93.1° | 83.5° |
| CAC | NAH | CAI | OAD | 1.4° | 6.1° |
| CAC | NAH | CAI | CAJ | 179.9° | 174.0° |
| NAH | CAC | CAB | HAB1 | 13.8° | 60.0° |
| NAH | CAC | CAB | HAB2 | 107.1° | 60.0° |
| NAH | CAC | HAC1 | HAC2 | 119.3° | 120.0° |
| CAC | NAH | CAG | HAG1 | 26.9° | 156.5° |
| CAC | NAH | CAG | HAG2 | 146.7° | 36.6° |
| NAH | CAG | CAF | HAG1 | 120.0° | 120.0° |
| NAH | CAG | CAF | HAG2 | 120.2° | 120.1° |
| NAH | CAG | CAF | CAE | 161.5° | 174.2° |
| CAG | NAH | CAI | OAD | 179.5° | 173.9° |
| CAG | NAH | CAI | CAJ | 0.8° | 6.0° |
| CAG | NAH | CAC | HAC1 | 6.0° | 30.0° |
| CAG | NAH | CAC | HAC2 | 126.8° | 150.0° |
| NAH | CAG | HAG1 | HAG2 | 120.2° | 120.0° |
| NAH | CAG | CAF | HAF1 | 41.5° | 54.2° |
| NAH | CAG | CAF | HAF2 | 78.3° | 65.8° |
| CAI | NAH | CAG | CAF | 86.0° | 96.5° |
| NAH | CAI | OAD | CAJ | 178.6° | 179.9° |
| NAH | CAI | CAJ | OAN | 138.3° | 124.7° |
| NAH | CAI | CAJ | CAK | 99.8° | 115.3° |
| CAI | NAH | CAC | HAC1 | 174.8° | 150.0° |
| CAI | NAH | CAC | HAC2 | 54.0° | 30.0° |
| CAI | NAH | CAG | HAG1 | 154.0° | 23.5° |
| CAI | NAH | CAG | HAG2 | 34.2° | 143.4° |
| NAH | CAI | CAJ | HAJ | 20.3° | 4.6° |
| CAG | CAF | CAE | HAF1 | 120.0° | 120.0° |
| CAG | CAF | CAE | HAF2 | 120.2° | 120.0° |
| CAF | CAG | HAG1 | HAG2 | 120.2° | 120.0° |
| CAG | CAF | HAF1 | HAF2 | 120.2° | 120.0° |
| CAG | CAF | CAE | HAE1 | 71.7° | 64.9° |
| CAG | CAF | CAE | HAE2 | 48.3° | 55.1° |
| CAG | CAF | CAE | HAE3 | 168.3° | 175.1° |
| CAE | CAF | CAG | HAG1 | 78.5° | 65.8° |
| CAE | CAF | CAG | HAG2 | 41.3° | 54.1° |
| CAE | CAF | HAF1 | HAF2 | 120.2° | 120.0° |
| CAF | CAE | HAE1 | HAE2 | 120.0° | 120.0° |
| CAF | CAE | HAE1 | HAE3 | 120.0° | 120.0° |
| CAF | CAE | HAE2 | HAE3 | 120.0° | 120.0° |
| OAD | CAI | CAJ | OAN | 43.0° | 55.2° |
| OAD | CAI | CAJ | CAK | 78.9° | 64.8° |
| OAD | CAI | CAJ | HAJ | 161.0° | 175.3° |
| CAI | CAJ | OAN | CAK | 121.0° | 120.0° |
| CAI | CAJ | OAN | HAJ | 118.9° | 120.1° |
| CAI | CAJ | CAK | HAJ | 119.0° | 120.0° |
| CAI | CAJ | CAK | OAO | 62.7° | 54.6° |
| CAI | CAJ | CAK | CAL | 177.5° | 174.6° |
| CAI | CAJ | OAN | HAN | 164.2° | 59.9° |
| CAI | CAJ | CAK | HAK | 58.5° | 65.4° |
| OAN | CAJ | CAK | HAJ | 118.1° | 120.0° |
| OAN | CAJ | CAK | OAO | 174.5° | 174.6° |
| OAN | CAJ | CAK | CAL | 54.6° | 65.4° |
| OAN | CAJ | CAK | HAK | 64.4° | 54.7° |
| CAJ | CAK | OAO | CAL | 120.5° | 120.0° |
| CAJ | CAK | OAO | HAK | 120.6° | 119.9° |
| CAJ | CAK | CAL | HAK | 120.6° | 120.0° |
| CAJ | CAK | CAL | OAM | 73.5° | 175.0° |
| CAK | CAJ | OAN | HAN | 74.7° | 60.1° |
| CAJ | CAK | OAO | HAO | 75.4° | 58.7° |
| CAJ | CAK | CAL | HAL1 | 166.5° | 55.0° |
| CAJ | CAK | CAL | HAL2 | 46.7° | 65.0° |
| OAO | CAK | CAL | HAK | 121.2° | 120.0° |
| OAO | CAK | CAL | OAM | 44.7° | 65.0° |
| OAO | CAK | CAJ | HAJ | 56.4° | 65.4° |
| OAO | CAK | CAL | HAL1 | 75.3° | 175.0° |
| OAO | CAK | CAL | HAL2 | 164.9° | 55.0° |
| CAK | CAL | OAM | HAL1 | 120.0° | 120.0° |
| CAK | CAL | OAM | HAL2 | 120.2° | 120.0° |
| CAL | CAK | CAJ | HAJ | 63.5° | 54.6° |
| CAL | CAK | OAO | HAO | 164.2° | 61.3° |
| CAK | CAL | HAL1 | HAL2 | 120.2° | 120.0° |
| CAK | CAL | OAM | HAM | 20.2° | 180.0° |
| OAM | CAL | CAK | HAK | 165.9° | 55.0° |
| OAM | CAL | HAL1 | HAL2 | 120.2° | 120.0° |
| HAA1 | CAA | HAA2 | HAA3 | 120.0° | 120.0° |
| HAA1 | CAA | CAB | HAB1 | 5.2° | 60.0° |
| HAA1 | CAA | CAB | HAB2 | 126.1° | 59.9° |
| HAA2 | CAA | CAB | HAB1 | 125.2° | 60.0° |
| HAA2 | CAA | CAB | HAB2 | 113.9° | 180.0° |
| HAA3 | CAA | CAB | HAB1 | 114.8° | 180.0° |
| HAA3 | CAA | CAB | HAB2 | 6.1° | 60.0° |
| HAB1 | CAB | CAC | HAC1 | 133.8° | 180.0° |
| HAB1 | CAB | CAC | HAC2 | 105.4° | 60.0° |
| HAB2 | CAB | CAC | HAC1 | 12.9° | 60.0° |
| HAB2 | CAB | CAC | HAC2 | 133.7° | 180.0° |
| HAG1 | CAG | CAF | HAF1 | 161.5° | 174.2° |
| HAG1 | CAG | CAF | HAF2 | 41.7° | 54.2° |
| HAG2 | CAG | CAF | HAF1 | 78.7° | 65.9° |
| HAG2 | CAG | CAF | HAF2 | 161.5° | 174.1° |
| HAF1 | CAF | CAE | HAE1 | 168.3° | 175.0° |
| HAF1 | CAF | CAE | HAE2 | 71.7° | 64.9° |
| HAF1 | CAF | CAE | HAE3 | 48.3° | 55.1° |
| HAF2 | CAF | CAE | HAE1 | 48.5° | 55.1° |
| HAF2 | CAF | CAE | HAE2 | 168.5° | 175.1° |
| HAF2 | CAF | CAE | HAE3 | 71.5° | 64.9° |
| HAE1 | CAE | HAE2 | HAE3 | 120.0° | 120.0° |
| HAJ | CAJ | OAN | HAN | 45.3° | 180.0° |
| HAJ | CAJ | CAK | HAK | 177.5° | 174.6° |
| HAK | CAK | OAO | HAO | 45.2° | 178.6° |
| HAK | CAK | CAL | HAL1 | 45.9° | 65.0° |
| HAK | CAK | CAL | HAL2 | 73.9° | 175.0° |
| HAL1 | CAL | OAM | HAM | 99.9° | 60.0° |
| HAL2 | CAL | OAM | HAM | 140.3° | 60.1° |
