ERO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAF | doub | 1.33Å | 1.46Å | |
| CAF | CAJ | sing | 1.47Å | 1.42Å | |
| OAD | CAM | doub | 1.22Å | 1.22Å | |
| CAM | CAJ | sing | 1.48Å | 1.40Å | |
| CAM | NAH | sing | 1.35Å | 1.39Å | |
| CAJ | CAK | doub | 1.38Å | 1.42Å | |
| NAH | CAL | sing | 1.34Å | 1.38Å | |
| OAE | CAI | doub | 1.21Å | 1.21Å | |
| CAK | CAI | sing | 1.48Å | 1.39Å | |
| CAK | NAG | sing | 1.38Å | 1.36Å | |
| CAI | OAB | sing | 1.35Å | 1.28Å | |
| CAL | NAG | sing | 1.34Å | 1.39Å | |
| CAL | OAC | doub | 1.22Å | 1.23Å | |
| OAB | H1 | sing | 0.97Å | 0.95Å | |
| NAH | H2 | sing | 0.97Å | 1.00Å | |
| CAF | H4 | sing | 1.08Å | 1.08Å | |
| CAA | H6 | sing | 1.08Å | 1.08Å | |
| CAA | H7 | sing | 1.08Å | 1.08Å | |
| NAG | H9 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CAF | CAJ | 121.6° | 120.1° |
| CAA | CAF | H4 | 119.2° | 120.0° |
| CAF | CAA | H6 | 120.0° | 120.0° |
| CAF | CAA | H7 | 120.0° | 120.0° |
| CAF | CAJ | CAM | 121.4° | 121.0° |
| CAF | CAJ | CAK | 119.2° | 121.1° |
| CAJ | CAF | H4 | 119.2° | 119.9° |
| OAD | CAM | CAJ | 124.8° | 120.6° |
| OAD | CAM | NAH | 116.9° | 120.6° |
| CAJ | CAM | NAH | 118.2° | 118.7° |
| CAM | CAJ | CAK | 119.4° | 118.0° |
| CAM | NAH | CAL | 121.7° | 120.7° |
| CAM | NAH | H2 | 119.1° | 119.6° |
| CAJ | CAK | CAI | 123.0° | 120.5° |
| CAJ | CAK | NAG | 120.5° | 119.1° |
| NAH | CAL | NAG | 120.3° | 122.3° |
| NAH | CAL | OAC | 118.2° | 118.8° |
| CAL | NAH | H2 | 119.2° | 119.6° |
| OAE | CAI | CAK | 123.2° | 119.9° |
| OAE | CAI | OAB | 120.4° | 120.0° |
| CAI | CAK | NAG | 115.7° | 120.4° |
| CAK | CAI | OAB | 115.4° | 120.0° |
| CAK | NAG | CAL | 119.7° | 121.2° |
| CAK | NAG | H9 | 120.2° | 119.4° |
| CAI | OAB | H1 | 109.5° | 117.0° |
| NAG | CAL | OAC | 121.6° | 118.9° |
| CAL | NAG | H9 | 120.1° | 119.4° |
| H6 | CAA | H7 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CAF | CAJ | H4 | 180.0° | 179.9° |
| CAA | CAF | CAJ | CAM | 36.6° | 6.6° |
| CAA | CAF | CAJ | CAK | 142.2° | 174.0° |
| CAF | CAA | H6 | H7 | 180.0° | 179.9° |
| CAF | CAJ | CAM | OAD | 1.1° | 0.5° |
| CAF | CAJ | CAM | CAK | 178.8° | 179.5° |
| CAF | CAJ | CAM | NAH | 177.9° | 180.0° |
| CAF | CAJ | CAK | CAI | 6.8° | 0.4° |
| CAF | CAJ | CAK | NAG | 176.4° | 180.0° |
| CAJ | CAF | CAA | H6 | 180.0° | 6.2° |
| CAJ | CAF | CAA | H7 | 0.0° | 173.6° |
| OAD | CAM | CAJ | NAH | 176.8° | 179.5° |
| OAD | CAM | CAJ | CAK | 179.8° | 180.0° |
| OAD | CAM | NAH | CAL | 178.8° | 179.8° |
| OAD | CAM | NAH | H2 | 1.2° | 0.2° |
| CAJ | CAM | NAH | CAL | 1.7° | 0.3° |
| CAM | CAJ | CAK | CAI | 174.4° | 179.8° |
| CAM | CAJ | CAK | NAG | 4.9° | 0.5° |
| CAJ | CAM | NAH | H2 | 178.3° | 179.8° |
| CAM | CAJ | CAF | H4 | 143.4° | 173.5° |
| NAH | CAM | CAJ | CAK | 3.3° | 0.5° |
| CAM | NAH | CAL | H2 | 180.0° | 180.0° |
| CAM | NAH | CAL | NAG | 1.5° | 0.0° |
| CAM | NAH | CAL | OAC | 179.7° | 180.0° |
| CAJ | CAK | CAI | OAE | 50.0° | 5.8° |
| CAJ | CAK | CAI | NAG | 170.0° | 179.7° |
| CAJ | CAK | CAI | OAB | 118.5° | 174.1° |
| CAJ | CAK | NAG | CAL | 4.6° | 0.3° |
| CAK | CAJ | CAF | H4 | 37.9° | 5.9° |
| CAJ | CAK | NAG | H9 | 175.4° | 179.8° |
| NAH | CAL | NAG | CAK | 2.9° | 0.0° |
| NAH | CAL | NAG | OAC | 178.8° | 180.0° |
| NAH | CAL | NAG | H9 | 177.1° | 180.0° |
| OAE | CAI | CAK | OAB | 168.5° | 180.0° |
| OAE | CAI | CAK | NAG | 140.0° | 174.5° |
| OAE | CAI | OAB | H1 | 0.0° | 0.1° |
| CAI | CAK | NAG | CAL | 174.9° | 180.0° |
| CAK | CAI | OAB | H1 | 168.8° | 179.9° |
| CAI | CAK | NAG | H9 | 5.1° | 0.1° |
| NAG | CAK | CAI | OAB | 51.5° | 5.5° |
| CAK | NAG | CAL | H9 | 180.0° | 180.0° |
| CAK | NAG | CAL | OAC | 178.3° | 180.0° |
| NAG | CAL | NAH | H2 | 178.5° | 180.0° |
| OAC | CAL | NAH | H2 | 0.4° | 0.0° |
| OAC | CAL | NAG | H9 | 1.7° | 0.0° |
| H4 | CAF | CAA | H6 | 0.0° | 173.7° |
| H4 | CAF | CAA | H7 | 180.0° | 6.5° |
