C0D
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CAA | CAJ | sing | 1.53Å | 1.52Å | |
CAJ | CAK | sing | 1.53Å | 1.44Å | |
CAK | CAL | sing | 1.53Å | 1.52Å | |
CAL | CAM | sing | 1.53Å | 1.51Å | |
CAM | NAQ | sing | 1.46Å | 1.47Å | |
NAQ | CAT | sing | 1.35Å | 1.34Å | |
OAD | CAT | doub | 1.21Å | 1.24Å | |
CAT | CAO | sing | 1.51Å | 1.51Å | |
CAO | CAN | sing | 1.53Å | 1.54Å | |
CAN | NAR | sing | 1.46Å | 1.46Å | |
OAE | CAU | doub | 1.21Å | 1.23Å | |
NAR | CAU | sing | 1.35Å | 1.35Å | |
CAC | CAW | sing | 1.53Å | 1.56Å | |
CAU | CAV | sing | 1.51Å | 1.51Å | |
CAB | CAW | sing | 1.53Å | 1.58Å | |
CAW | CAV | sing | 1.53Å | 1.58Å | |
CAW | CAP | sing | 1.53Å | 1.55Å | |
CAV | OAG | sing | 1.43Å | 1.42Å | |
CAP | H1 | sing | 1.09Å | 1.10Å | |
CAP | H2 | sing | 1.09Å | 1.10Å | |
CAP | H3 | sing | 1.09Å | 1.10Å | |
CAB | H4 | sing | 1.09Å | 1.10Å | |
CAB | H5 | sing | 1.09Å | 1.10Å | |
CAB | H6 | sing | 1.09Å | 1.10Å | |
CAC | H7 | sing | 1.09Å | 1.10Å | |
CAC | H8 | sing | 1.09Å | 1.10Å | |
CAC | H9 | sing | 1.09Å | 1.10Å | |
CAV | H10 | sing | 1.09Å | 1.10Å | |
OAG | H11 | sing | 0.97Å | 0.95Å | |
NAR | H12 | sing | 0.97Å | 1.00Å | |
CAN | H13 | sing | 1.09Å | 1.10Å | |
CAN | H14 | sing | 1.09Å | 1.10Å | |
CAO | H15 | sing | 1.09Å | 1.10Å | |
CAO | H16 | sing | 1.09Å | 1.10Å | |
NAQ | H17 | sing | 0.97Å | 1.00Å | |
CAM | H18 | sing | 1.09Å | 1.10Å | |
CAM | H19 | sing | 1.09Å | 1.10Å | |
CAL | H20 | sing | 1.09Å | 1.10Å | |
CAL | H21 | sing | 1.09Å | 1.10Å | |
CAK | H22 | sing | 1.09Å | 1.10Å | |
CAK | H23 | sing | 1.09Å | 1.10Å | |
CAJ | H24 | sing | 1.09Å | 1.10Å | |
CAJ | H25 | sing | 1.09Å | 1.10Å | |
CAA | H26 | sing | 1.09Å | 1.10Å | |
CAA | H27 | sing | 1.09Å | 1.10Å | |
CAA | H28 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CAA | CAJ | CAK | 107.6° | 109.5° |
CAA | CAJ | H24 | 110.0° | 109.5° |
CAA | CAJ | H25 | 109.9° | 109.4° |
CAJ | CAA | H26 | 109.5° | 109.4° |
CAJ | CAA | H27 | 109.5° | 109.5° |
CAJ | CAA | H28 | 109.5° | 109.4° |
CAJ | CAK | CAL | 108.9° | 109.4° |
CAJ | CAK | H22 | 109.6° | 109.4° |
CAJ | CAK | H23 | 109.6° | 109.5° |
CAK | CAJ | H24 | 110.0° | 109.4° |
CAK | CAJ | H25 | 109.9° | 109.5° |
CAK | CAL | CAM | 102.3° | 109.4° |
CAK | CAL | H20 | 111.2° | 109.5° |
CAK | CAL | H21 | 111.2° | 109.5° |
CAL | CAK | H22 | 109.6° | 109.5° |
CAL | CAK | H23 | 109.6° | 109.5° |
CAL | CAM | NAQ | 110.5° | 109.5° |
CAL | CAM | H18 | 109.2° | 109.4° |
CAL | CAM | H19 | 109.2° | 109.5° |
CAM | CAL | H20 | 111.2° | 109.4° |
CAM | CAL | H21 | 111.2° | 109.5° |
CAM | NAQ | CAT | 120.9° | 120.0° |
CAM | NAQ | H17 | 119.6° | 120.0° |
NAQ | CAM | H18 | 109.2° | 109.5° |
NAQ | CAM | H19 | 109.2° | 109.5° |
NAQ | CAT | OAD | 122.5° | 120.0° |
NAQ | CAT | CAO | 115.2° | 120.0° |
CAT | NAQ | H17 | 119.5° | 120.0° |
OAD | CAT | CAO | 122.2° | 120.0° |
CAT | CAO | CAN | 109.9° | 109.5° |
CAT | CAO | H15 | 109.4° | 109.5° |
CAT | CAO | H16 | 109.4° | 109.5° |
CAO | CAN | NAR | 111.9° | 109.5° |
CAO | CAN | H13 | 108.9° | 109.5° |
CAO | CAN | H14 | 108.9° | 109.4° |
CAN | CAO | H15 | 109.3° | 109.5° |
CAN | CAO | H16 | 109.4° | 109.4° |
CAN | NAR | CAU | 123.0° | 120.0° |
CAN | NAR | H12 | 118.5° | 120.1° |
NAR | CAN | H13 | 108.9° | 109.5° |
NAR | CAN | H14 | 108.9° | 109.5° |
OAE | CAU | NAR | 124.1° | 120.0° |
OAE | CAU | CAV | 118.8° | 120.0° |
NAR | CAU | CAV | 116.5° | 120.0° |
CAU | NAR | H12 | 118.5° | 119.9° |
CAC | CAW | CAB | 108.4° | 109.4° |
CAC | CAW | CAV | 108.1° | 109.5° |
CAC | CAW | CAP | 108.9° | 109.5° |
CAW | CAC | H7 | 109.5° | 109.5° |
CAW | CAC | H8 | 109.5° | 109.5° |
CAW | CAC | H9 | 109.5° | 109.4° |
CAU | CAV | CAW | 112.3° | 109.4° |
CAU | CAV | OAG | 110.8° | 109.5° |
CAU | CAV | H10 | 107.8° | 109.5° |
CAB | CAW | CAV | 111.1° | 109.5° |
CAB | CAW | CAP | 109.1° | 109.5° |
CAW | CAB | H4 | 109.5° | 109.5° |
CAW | CAB | H5 | 109.5° | 109.5° |
CAW | CAB | H6 | 109.5° | 109.5° |
CAV | CAW | CAP | 111.1° | 109.5° |
CAW | CAV | OAG | 109.8° | 109.5° |
CAW | CAV | H10 | 107.0° | 109.5° |
CAW | CAP | H1 | 109.5° | 109.4° |
CAW | CAP | H2 | 109.5° | 109.4° |
CAW | CAP | H3 | 109.5° | 109.4° |
OAG | CAV | H10 | 109.0° | 109.5° |
CAV | OAG | H11 | 109.5° | 114.0° |
H1 | CAP | H2 | 109.5° | 109.5° |
H1 | CAP | H3 | 109.5° | 109.5° |
H2 | CAP | H3 | 109.5° | 109.5° |
H4 | CAB | H5 | 109.4° | 109.4° |
H4 | CAB | H6 | 109.4° | 109.5° |
H5 | CAB | H6 | 109.5° | 109.5° |
H7 | CAC | H8 | 109.5° | 109.5° |
H7 | CAC | H9 | 109.4° | 109.5° |
H8 | CAC | H9 | 109.5° | 109.4° |
H13 | CAN | H14 | 109.5° | 109.5° |
H15 | CAO | H16 | 109.5° | 109.4° |
H18 | CAM | H19 | 109.5° | 109.4° |
H20 | CAL | H21 | 109.5° | 109.5° |
H22 | CAK | H23 | 109.5° | 109.5° |
H24 | CAJ | H25 | 109.5° | 109.5° |
H26 | CAA | H27 | 109.5° | 109.5° |
H26 | CAA | H28 | 109.5° | 109.5° |
H27 | CAA | H28 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CAA | CAJ | CAK | H24 | 119.7° | 120.0° |
CAA | CAJ | CAK | H25 | 119.7° | 120.0° |
CAA | CAJ | CAK | CAL | 155.2° | 180.0° |
CAA | CAJ | CAK | H22 | 84.9° | 60.0° |
CAA | CAJ | CAK | H23 | 35.3° | 60.0° |
CAA | CAJ | H24 | H25 | 120.9° | 120.0° |
CAJ | CAA | H26 | H27 | 120.0° | 120.0° |
CAJ | CAA | H26 | H28 | 120.0° | 120.0° |
CAJ | CAA | H27 | H28 | 120.0° | 120.0° |
CAJ | CAK | CAL | H22 | 119.9° | 119.9° |
CAJ | CAK | CAL | H23 | 119.9° | 120.0° |
CAJ | CAK | CAL | CAM | 150.8° | 180.0° |
CAJ | CAK | CAL | H20 | 90.4° | 60.1° |
CAJ | CAK | CAL | H21 | 31.9° | 60.0° |
CAJ | CAK | H22 | H23 | 120.2° | 120.0° |
CAK | CAJ | H24 | H25 | 120.9° | 120.0° |
CAK | CAJ | CAA | H26 | 180.0° | 180.0° |
CAK | CAJ | CAA | H27 | 60.0° | 60.0° |
CAK | CAJ | CAA | H28 | 60.0° | 60.0° |
CAK | CAL | CAM | H20 | 118.8° | 119.9° |
CAK | CAL | CAM | H21 | 118.8° | 120.0° |
CAK | CAL | CAM | NAQ | 91.8° | 180.0° |
CAK | CAL | CAM | H18 | 148.0° | 60.1° |
CAK | CAL | CAM | H19 | 28.3° | 59.9° |
CAK | CAL | H20 | H21 | 123.3° | 120.0° |
CAL | CAK | H22 | H23 | 120.3° | 120.1° |
CAL | CAK | CAJ | H24 | 35.5° | 60.1° |
CAL | CAK | CAJ | H25 | 85.1° | 60.0° |
CAL | CAM | NAQ | H18 | 120.1° | 120.0° |
CAL | CAM | NAQ | H19 | 120.2° | 120.1° |
CAL | CAM | NAQ | CAT | 169.5° | 180.0° |
CAL | CAM | NAQ | H17 | 10.5° | 0.0° |
CAL | CAM | H18 | H19 | 119.5° | 120.0° |
CAM | CAL | H20 | H21 | 123.4° | 120.0° |
CAM | CAL | CAK | H22 | 30.8° | 60.1° |
CAM | CAL | CAK | H23 | 89.3° | 60.0° |
CAM | NAQ | CAT | H17 | 180.0° | 180.0° |
CAM | NAQ | CAT | OAD | 7.4° | 0.0° |
CAM | NAQ | CAT | CAO | 174.4° | 180.0° |
NAQ | CAM | H18 | H19 | 119.5° | 120.0° |
NAQ | CAM | CAL | H20 | 27.0° | 60.0° |
NAQ | CAM | CAL | H21 | 149.3° | 60.0° |
NAQ | CAT | OAD | CAO | 178.1° | 180.0° |
NAQ | CAT | CAO | CAN | 89.2° | 180.0° |
NAQ | CAT | CAO | H15 | 150.8° | 60.0° |
NAQ | CAT | CAO | H16 | 30.9° | 60.0° |
CAT | NAQ | CAM | H18 | 49.3° | 60.0° |
CAT | NAQ | CAM | H19 | 70.4° | 60.0° |
OAD | CAT | CAO | CAN | 92.6° | 0.0° |
OAD | CAT | CAO | H15 | 27.5° | 120.0° |
OAD | CAT | CAO | H16 | 147.4° | 120.0° |
OAD | CAT | NAQ | H17 | 172.7° | 180.0° |
CAT | CAO | CAN | H15 | 120.1° | 120.1° |
CAT | CAO | CAN | H16 | 120.1° | 120.0° |
CAT | CAO | CAN | NAR | 166.1° | 180.0° |
CAT | CAO | CAN | H13 | 73.5° | 60.0° |
CAT | CAO | CAN | H14 | 45.8° | 60.0° |
CAT | CAO | H15 | H16 | 119.8° | 120.0° |
CAO | CAT | NAQ | H17 | 5.6° | 0.1° |
CAO | CAN | NAR | H13 | 120.4° | 120.0° |
CAO | CAN | NAR | H14 | 120.4° | 120.0° |
CAO | CAN | NAR | CAU | 81.7° | 180.0° |
CAO | CAN | NAR | H12 | 98.3° | 0.0° |
CAO | CAN | H13 | H14 | 118.9° | 120.0° |
CAN | CAO | H15 | H16 | 119.8° | 119.9° |
CAN | NAR | CAU | OAE | 11.0° | 4.9° |
CAN | NAR | CAU | H12 | 180.0° | 180.0° |
CAN | NAR | CAU | CAV | 178.4° | 175.1° |
NAR | CAN | H13 | H14 | 118.9° | 120.0° |
NAR | CAN | CAO | H15 | 46.1° | 60.0° |
NAR | CAN | CAO | H16 | 73.8° | 60.0° |
OAE | CAU | NAR | CAV | 170.5° | 180.0° |
OAE | CAU | CAV | CAW | 61.5° | 107.2° |
OAE | CAU | CAV | OAG | 175.3° | 12.8° |
OAE | CAU | CAV | H10 | 56.1° | 132.8° |
OAE | CAU | NAR | H12 | 169.0° | 175.1° |
NAR | CAU | CAV | CAW | 109.6° | 72.8° |
NAR | CAU | CAV | OAG | 13.6° | 167.1° |
NAR | CAU | CAV | H10 | 132.8° | 47.2° |
CAU | NAR | CAN | H13 | 158.0° | 60.0° |
CAU | NAR | CAN | H14 | 38.7° | 60.0° |
CAC | CAW | CAV | CAU | 55.6° | 65.4° |
CAC | CAW | CAB | CAV | 118.6° | 120.0° |
CAC | CAW | CAB | CAP | 118.5° | 120.0° |
CAC | CAW | CAV | CAP | 119.4° | 120.0° |
CAC | CAW | CAV | OAG | 68.2° | 174.6° |
CAC | CAW | CAP | H1 | 180.0° | 60.0° |
CAC | CAW | CAP | H2 | 60.0° | 60.0° |
CAC | CAW | CAP | H3 | 60.0° | 180.0° |
CAC | CAW | CAB | H4 | 180.0° | 180.0° |
CAC | CAW | CAB | H5 | 60.0° | 60.0° |
CAC | CAW | CAB | H6 | 60.0° | 60.0° |
CAW | CAC | H7 | H8 | 120.0° | 120.0° |
CAW | CAC | H7 | H9 | 120.0° | 120.0° |
CAW | CAC | H8 | H9 | 120.0° | 119.9° |
CAC | CAW | CAV | H10 | 173.6° | 54.6° |
CAU | CAV | CAW | CAB | 63.3° | 54.6° |
CAU | CAV | CAW | OAG | 123.8° | 120.0° |
CAU | CAV | CAW | H10 | 118.1° | 120.0° |
CAU | CAV | CAW | CAP | 175.0° | 174.6° |
CAU | CAV | OAG | H10 | 118.4° | 120.0° |
CAU | CAV | OAG | H11 | 180.0° | 60.0° |
CAV | CAU | NAR | H12 | 1.5° | 4.9° |
CAB | CAW | CAV | CAP | 121.7° | 120.0° |
CAB | CAW | CAV | OAG | 173.0° | 65.4° |
CAB | CAW | CAP | H1 | 61.8° | 180.0° |
CAB | CAW | CAP | H2 | 58.2° | 59.9° |
CAB | CAW | CAP | H3 | 178.2° | 60.0° |
CAW | CAB | H4 | H5 | 120.0° | 120.0° |
CAW | CAB | H4 | H6 | 120.0° | 120.0° |
CAW | CAB | H5 | H6 | 120.0° | 120.0° |
CAB | CAW | CAC | H7 | 180.0° | 53.0° |
CAB | CAW | CAC | H8 | 60.0° | 67.1° |
CAB | CAW | CAC | H9 | 60.0° | 173.0° |
CAB | CAW | CAV | H10 | 54.8° | 174.6° |
CAW | CAV | OAG | H10 | 116.9° | 120.0° |
CAV | CAW | CAP | H1 | 61.1° | 60.0° |
CAV | CAW | CAP | H2 | 178.9° | 180.0° |
CAV | CAW | CAP | H3 | 58.9° | 60.0° |
CAV | CAW | CAB | H4 | 61.4° | 60.0° |
CAV | CAW | CAB | H5 | 58.6° | 179.9° |
CAV | CAW | CAB | H6 | 178.6° | 60.0° |
CAV | CAW | CAC | H7 | 59.5° | 67.1° |
CAV | CAW | CAC | H8 | 179.5° | 172.9° |
CAV | CAW | CAC | H9 | 60.5° | 53.0° |
CAW | CAV | OAG | H11 | 55.4° | 60.0° |
CAP | CAW | CAV | OAG | 51.3° | 54.6° |
CAW | CAP | H1 | H2 | 120.0° | 120.0° |
CAW | CAP | H1 | H3 | 120.0° | 119.9° |
CAW | CAP | H2 | H3 | 120.0° | 120.0° |
CAP | CAW | CAB | H4 | 61.5° | 60.0° |
CAP | CAW | CAB | H5 | 178.5° | 59.9° |
CAP | CAW | CAB | H6 | 58.5° | 180.0° |
CAP | CAW | CAC | H7 | 61.3° | 172.9° |
CAP | CAW | CAC | H8 | 58.7° | 52.9° |
CAP | CAW | CAC | H9 | 178.7° | 67.0° |
CAP | CAW | CAV | H10 | 66.9° | 65.4° |
H1 | CAP | H2 | H3 | 120.0° | 120.1° |
H4 | CAB | H5 | H6 | 120.0° | 120.0° |
H7 | CAC | H8 | H9 | 120.0° | 120.1° |
H10 | CAV | OAG | H11 | 61.6° | 180.0° |
H12 | NAR | CAN | H13 | 22.0° | 120.0° |
H12 | NAR | CAN | H14 | 141.3° | 120.0° |
H13 | CAN | CAO | H15 | 166.4° | 180.0° |
H13 | CAN | CAO | H16 | 46.6° | 60.0° |
H14 | CAN | CAO | H15 | 74.3° | 60.0° |
H14 | CAN | CAO | H16 | 165.8° | 180.0° |
H17 | NAQ | CAM | H18 | 130.6° | 119.9° |
H17 | NAQ | CAM | H19 | 109.7° | 120.1° |
H18 | CAM | CAL | H20 | 93.1° | 180.0° |
H18 | CAM | CAL | H21 | 29.2° | 60.0° |
H19 | CAM | CAL | H20 | 147.1° | 60.0° |
H19 | CAM | CAL | H21 | 90.5° | 179.9° |
H20 | CAL | CAK | H22 | 149.7° | 180.0° |
H20 | CAL | CAK | H23 | 29.5° | 60.0° |
H21 | CAL | CAK | H22 | 88.0° | 60.0° |
H21 | CAL | CAK | H23 | 151.8° | 180.0° |
H22 | CAK | CAJ | H24 | 155.4° | 180.0° |
H22 | CAK | CAJ | H25 | 34.8° | 60.0° |
H23 | CAK | CAJ | H24 | 84.4° | 60.0° |
H23 | CAK | CAJ | H25 | 155.0° | 180.0° |
H24 | CAJ | CAA | H26 | 60.3° | 60.0° |
H24 | CAJ | CAA | H27 | 59.7° | NaN° |
H24 | CAJ | CAA | H28 | 179.7° | 60.0° |
H25 | CAJ | CAA | H26 | 60.3° | 60.0° |
H25 | CAJ | CAA | H27 | 179.7° | 60.0° |
H25 | CAJ | CAA | H28 | 59.7° | 180.0° |
H26 | CAA | H27 | H28 | 120.0° | 120.1° |