BM8
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
NAQ | CAM | sing | 1.39Å | 1.45Å | |
CAM | CAN | doub | 1.39Å | 1.38Å | Aromatic |
CAM | CAL | sing | 1.39Å | 1.39Å | Aromatic |
CAP | CAL | sing | 1.51Å | 1.53Å | |
CAN | CAO | sing | 1.38Å | 1.39Å | Aromatic |
CAL | CAK | doub | 1.38Å | 1.39Å | Aromatic |
CAO | CAJ | doub | 1.40Å | 1.39Å | Aromatic |
CAK | CAJ | sing | 1.40Å | 1.38Å | Aromatic |
CAJ | CAH | sing | 1.48Å | 1.52Å | |
CAH | NAG | doub | 1.29Å | 1.33Å | Aromatic |
CAH | SAI | sing | 1.76Å | 1.70Å | Aromatic |
NAG | CAE | sing | 1.34Å | 1.40Å | Aromatic |
SAI | CAF | sing | 1.76Å | 1.71Å | Aromatic |
CAE | CAF | doub | 1.40Å | 1.39Å | Aromatic |
CAE | CAD | sing | 1.41Å | 1.41Å | Aromatic |
CAF | CAA | sing | 1.39Å | 1.40Å | Aromatic |
CAD | CAC | doub | 1.36Å | 1.38Å | Aromatic |
CAA | CAB | doub | 1.38Å | 1.40Å | Aromatic |
CAC | CAB | sing | 1.39Å | 1.40Å | Aromatic |
CAA | H1 | sing | 1.08Å | 1.08Å | |
CAB | H2 | sing | 1.08Å | 1.08Å | |
CAC | H3 | sing | 1.08Å | 1.08Å | |
CAD | H4 | sing | 1.08Å | 1.08Å | |
CAK | H5 | sing | 1.08Å | 1.08Å | |
CAN | H6 | sing | 1.08Å | 1.08Å | |
CAO | H7 | sing | 1.08Å | 1.08Å | |
CAP | H8 | sing | 1.09Å | 1.10Å | |
CAP | H9 | sing | 1.09Å | 1.10Å | |
CAP | H10 | sing | 1.09Å | 1.10Å | |
NAQ | H11 | sing | 0.97Å | 1.00Å | |
NAQ | H12 | sing | 0.97Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
NAQ | CAM | CAN | 119.8° | 119.9° |
NAQ | CAM | CAL | 120.2° | 120.0° |
CAM | NAQ | H11 | 109.5° | 120.1° |
CAM | NAQ | H12 | 109.5° | 120.0° |
CAN | CAM | CAL | 120.0° | 120.1° |
CAM | CAN | CAO | 120.0° | 120.1° |
CAM | CAN | H6 | 120.0° | 120.0° |
CAM | CAL | CAP | 120.1° | 119.9° |
CAM | CAL | CAK | 120.0° | 120.1° |
CAP | CAL | CAK | 119.9° | 119.9° |
CAL | CAP | H8 | 109.5° | 109.5° |
CAL | CAP | H9 | 109.5° | 109.4° |
CAL | CAP | H10 | 109.5° | 109.5° |
CAN | CAO | CAJ | 120.0° | 119.9° |
CAO | CAN | H6 | 120.0° | 119.9° |
CAN | CAO | H7 | 120.0° | 120.0° |
CAL | CAK | CAJ | 119.9° | 119.9° |
CAL | CAK | H5 | 120.0° | 120.1° |
CAO | CAJ | CAK | 120.1° | 119.8° |
CAO | CAJ | CAH | 119.8° | 120.1° |
CAJ | CAO | H7 | 120.0° | 120.0° |
CAK | CAJ | CAH | 120.1° | 120.0° |
CAJ | CAK | H5 | 120.0° | 120.0° |
CAJ | CAH | NAG | 127.1° | 124.8° |
CAJ | CAH | SAI | 126.6° | 124.9° |
NAG | CAH | SAI | 106.2° | 110.3° |
CAH | NAG | CAE | 115.8° | 117.9° |
CAH | SAI | CAF | 98.7° | 90.4° |
NAG | CAE | CAF | 116.0° | 112.9° |
NAG | CAE | CAD | 124.1° | 128.8° |
SAI | CAF | CAE | 103.3° | 108.4° |
SAI | CAF | CAA | 136.5° | 131.3° |
CAF | CAE | CAD | 119.9° | 118.3° |
CAE | CAF | CAA | 120.2° | 120.3° |
CAE | CAD | CAC | 119.9° | 120.5° |
CAE | CAD | H4 | 120.0° | 119.7° |
CAF | CAA | CAB | 119.8° | 120.1° |
CAF | CAA | H1 | 120.1° | 120.0° |
CAD | CAC | CAB | 120.1° | 120.8° |
CAD | CAC | H3 | 119.9° | 119.6° |
CAC | CAD | H4 | 120.1° | 119.7° |
CAA | CAB | CAC | 120.1° | 120.0° |
CAB | CAA | H1 | 120.1° | 119.9° |
CAA | CAB | H2 | 120.0° | 120.1° |
CAC | CAB | H2 | 120.0° | 120.0° |
CAB | CAC | H3 | 119.9° | 119.6° |
H8 | CAP | H9 | 109.5° | 109.5° |
H8 | CAP | H10 | 109.4° | 109.5° |
H9 | CAP | H10 | 109.5° | 109.4° |
H11 | NAQ | H12 | 109.5° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
NAQ | CAM | CAN | CAL | 180.0° | 179.7° |
NAQ | CAM | CAL | CAP | 0.0° | 0.3° |
NAQ | CAM | CAN | CAO | 179.9° | 180.0° |
NAQ | CAM | CAL | CAK | 179.9° | 179.7° |
NAQ | CAM | CAN | H6 | 0.1° | 0.3° |
CAM | NAQ | H11 | H12 | 120.0° | 180.0° |
CAN | CAM | CAL | CAP | 180.0° | 180.0° |
CAM | CAN | CAO | H6 | 180.0° | 179.7° |
CAN | CAM | CAL | CAK | 0.1° | 0.0° |
CAM | CAN | CAO | CAJ | 0.2° | 0.6° |
CAM | CAN | CAO | H7 | 179.9° | 179.9° |
CAN | CAM | NAQ | H11 | 180.0° | 0.0° |
CAN | CAM | NAQ | H12 | 60.0° | 180.0° |
CAM | CAL | CAP | CAK | 179.9° | 180.0° |
CAL | CAM | CAN | CAO | 0.1° | 0.3° |
CAM | CAL | CAK | CAJ | 0.2° | 0.0° |
CAM | CAL | CAK | H5 | 179.8° | 180.0° |
CAL | CAM | CAN | H6 | 179.9° | 180.0° |
CAM | CAL | CAP | H8 | 90.0° | 90.0° |
CAM | CAL | CAP | H9 | 149.9° | 30.0° |
CAM | CAL | CAP | H10 | 30.0° | 150.0° |
CAL | CAM | NAQ | H11 | 0.0° | 179.7° |
CAL | CAM | NAQ | H12 | 120.0° | 0.3° |
CAP | CAL | CAK | CAJ | 179.9° | 180.0° |
CAP | CAL | CAK | H5 | 0.1° | 0.0° |
CAL | CAP | H8 | H9 | 120.0° | 120.0° |
CAL | CAP | H8 | H10 | 120.0° | 120.1° |
CAL | CAP | H9 | H10 | 120.0° | 120.0° |
CAN | CAO | CAJ | H7 | 180.0° | 179.5° |
CAN | CAO | CAJ | CAK | 0.0° | 0.6° |
CAN | CAO | CAJ | CAH | 179.8° | 179.8° |
CAL | CAK | CAJ | CAO | 0.2° | 0.3° |
CAL | CAK | CAJ | H5 | 180.0° | 180.0° |
CAL | CAK | CAJ | CAH | 180.0° | 180.0° |
CAK | CAL | CAP | H8 | 90.1° | 90.0° |
CAK | CAL | CAP | H9 | 30.0° | 150.0° |
CAK | CAL | CAP | H10 | 150.0° | 30.0° |
CAO | CAJ | CAK | CAH | 179.8° | 179.7° |
CAO | CAJ | CAH | NAG | 148.7° | 0.4° |
CAO | CAJ | CAH | SAI | 31.3° | 179.1° |
CAO | CAJ | CAK | H5 | 179.8° | 179.7° |
CAJ | CAO | CAN | H6 | 179.8° | 179.7° |
CAK | CAJ | CAH | NAG | 31.5° | 180.0° |
CAK | CAJ | CAH | SAI | 148.5° | 0.6° |
CAK | CAJ | CAO | H7 | 180.0° | 179.9° |
CAJ | CAH | NAG | SAI | 180.0° | 179.5° |
CAJ | CAH | NAG | CAE | 179.9° | 180.0° |
CAJ | CAH | SAI | CAF | 179.9° | 179.8° |
CAH | CAJ | CAK | H5 | 0.0° | 0.0° |
CAH | CAJ | CAO | H7 | 0.2° | 0.3° |
NAG | CAH | SAI | CAF | 0.1° | 0.7° |
CAH | NAG | CAE | CAF | 0.1° | 0.1° |
CAH | NAG | CAE | CAD | 180.0° | 179.4° |
SAI | CAH | NAG | CAE | 0.1° | 0.5° |
CAH | SAI | CAF | CAE | 0.0° | 0.7° |
CAH | SAI | CAF | CAA | 180.0° | 180.0° |
NAG | CAE | CAF | SAI | 0.1° | 0.6° |
NAG | CAE | CAF | CAD | 179.9° | 179.4° |
NAG | CAE | CAF | CAA | 179.9° | 180.0° |
NAG | CAE | CAD | CAC | 179.9° | 179.6° |
NAG | CAE | CAD | H4 | 0.1° | 0.4° |
SAI | CAF | CAE | CAA | 180.0° | 179.4° |
SAI | CAF | CAE | CAD | 180.0° | 180.0° |
SAI | CAF | CAA | CAB | 179.9° | 179.8° |
SAI | CAF | CAA | H1 | 0.1° | 0.4° |
CAF | CAE | CAD | CAC | 0.0° | 0.3° |
CAE | CAF | CAA | CAB | 0.0° | 0.5° |
CAE | CAF | CAA | H1 | 179.9° | 179.7° |
CAF | CAE | CAD | H4 | 180.0° | 179.7° |
CAD | CAE | CAF | CAA | 0.0° | 0.6° |
CAE | CAD | CAC | H4 | 180.0° | 180.0° |
CAE | CAD | CAC | CAB | 0.1° | 0.0° |
CAE | CAD | CAC | H3 | 179.9° | 180.0° |
CAF | CAA | CAB | H1 | 180.0° | 179.8° |
CAF | CAA | CAB | CAC | 0.0° | 0.2° |
CAF | CAA | CAB | H2 | 180.0° | 179.7° |
CAD | CAC | CAB | CAA | 0.0° | 0.0° |
CAD | CAC | CAB | H3 | 180.0° | 180.0° |
CAD | CAC | CAB | H2 | 179.9° | 180.0° |
CAA | CAB | CAC | H2 | 180.0° | 180.0° |
CAA | CAB | CAC | H3 | 180.0° | 180.0° |
CAC | CAB | CAA | H1 | 180.0° | 180.0° |
CAB | CAC | CAD | H4 | 179.9° | 180.0° |
H1 | CAA | CAB | H2 | 0.0° | 0.0° |
H2 | CAB | CAC | H3 | 0.1° | 0.0° |
H3 | CAC | CAD | H4 | 0.1° | 0.0° |
H6 | CAN | CAO | H7 | 0.1° | 0.2° |
H8 | CAP | H9 | H10 | 120.0° | 120.0° |