E0A
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAU | SAQ | doub | 1.42Å | 1.52Å | |
| OAT | SAQ | doub | 1.42Å | 1.51Å | |
| CAV | CAS | sing | 1.53Å | 1.51Å | |
| CAV | CAW | sing | 1.53Å | 1.47Å | |
| CAR | SAQ | sing | 1.81Å | 1.81Å | |
| CAR | CAS | sing | 1.53Å | 1.52Å | |
| SAQ | NAP | sing | 1.66Å | 1.59Å | |
| NAP | CAC | sing | 1.39Å | 1.38Å | |
| CAB | CAC | doub | 1.39Å | 1.41Å | Aromatic |
| CAB | CAA | sing | 1.39Å | 1.41Å | Aromatic |
| CAC | CAD | sing | 1.41Å | 1.43Å | Aromatic |
| CAA | CAF | doub | 1.38Å | 1.37Å | Aromatic |
| CAD | CAG | doub | 1.40Å | 1.42Å | Aromatic |
| CAD | CAE | sing | 1.40Å | 1.36Å | Aromatic |
| CAG | CAH | sing | 1.38Å | 1.41Å | Aromatic |
| CAF | CAE | sing | 1.39Å | 1.33Å | Aromatic |
| CAF | NAK | sing | 1.39Å | 1.36Å | |
| CAE | CAJ | doub | 1.40Å | 1.38Å | Aromatic |
| CAH | CAI | doub | 1.39Å | 1.41Å | Aromatic |
| CAO | CAN | sing | 1.53Å | 1.51Å | |
| NAK | CAN | sing | 1.46Å | 1.44Å | |
| NAK | CAL | sing | 1.36Å | 1.36Å | |
| CAJ | CAI | sing | 1.38Å | 1.35Å | Aromatic |
| CAJ | CAL | sing | 1.47Å | 1.35Å | |
| CAL | OAM | doub | 1.22Å | 1.26Å | |
| CAW | H1 | sing | 1.09Å | 1.10Å | |
| CAW | H2 | sing | 1.09Å | 1.10Å | |
| CAW | H3 | sing | 1.09Å | 1.10Å | |
| CAV | H4 | sing | 1.09Å | 1.10Å | |
| CAV | H5 | sing | 1.09Å | 1.10Å | |
| CAS | H6 | sing | 1.09Å | 1.10Å | |
| CAS | H7 | sing | 1.09Å | 1.10Å | |
| CAR | H8 | sing | 1.09Å | 1.10Å | |
| CAR | H9 | sing | 1.09Å | 1.10Å | |
| NAP | H10 | sing | 0.97Å | 1.00Å | |
| CAB | H11 | sing | 1.08Å | 1.08Å | |
| CAA | H12 | sing | 1.08Å | 1.08Å | |
| CAG | H13 | sing | 1.08Å | 1.08Å | |
| CAH | H14 | sing | 1.08Å | 1.08Å | |
| CAI | H15 | sing | 1.08Å | 1.08Å | |
| CAN | H16 | sing | 1.09Å | 1.10Å | |
| CAN | H17 | sing | 1.09Å | 1.10Å | |
| CAO | H18 | sing | 1.09Å | 1.10Å | |
| CAO | H19 | sing | 1.09Å | 1.10Å | |
| CAO | H20 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAU | SAQ | OAT | 112.5° | 121.0° |
| OAU | SAQ | CAR | 108.0° | 110.5° |
| OAU | SAQ | NAP | 108.5° | 104.3° |
| OAT | SAQ | CAR | 105.6° | 110.6° |
| OAT | SAQ | NAP | 111.2° | 104.3° |
| CAS | CAV | CAW | 102.2° | 109.5° |
| CAV | CAS | CAR | 102.6° | 109.5° |
| CAS | CAV | H4 | 111.2° | 109.5° |
| CAS | CAV | H5 | 111.3° | 109.5° |
| CAV | CAS | H6 | 111.2° | 109.5° |
| CAV | CAS | H7 | 111.2° | 109.5° |
| CAV | CAW | H1 | 109.5° | 109.4° |
| CAV | CAW | H2 | 109.5° | 109.5° |
| CAV | CAW | H3 | 109.5° | 109.5° |
| CAW | CAV | H4 | 111.2° | 109.5° |
| CAW | CAV | H5 | 111.3° | 109.5° |
| SAQ | CAR | CAS | 106.0° | 109.5° |
| CAR | SAQ | NAP | 111.1° | 104.5° |
| SAQ | CAR | H8 | 110.3° | 109.5° |
| SAQ | CAR | H9 | 110.3° | 109.5° |
| CAR | CAS | H6 | 111.2° | 109.5° |
| CAR | CAS | H7 | 111.2° | 109.5° |
| CAS | CAR | H8 | 110.3° | 109.5° |
| CAS | CAR | H9 | 110.3° | 109.5° |
| SAQ | NAP | CAC | 121.4° | 120.0° |
| SAQ | NAP | H10 | 106.4° | 120.0° |
| NAP | CAC | CAB | 123.8° | 120.9° |
| NAP | CAC | CAD | 118.0° | 120.9° |
| CAC | NAP | H10 | 106.4° | 120.0° |
| CAC | CAB | CAA | 119.4° | 123.0° |
| CAB | CAC | CAD | 118.2° | 118.2° |
| CAC | CAB | H11 | 120.3° | 118.5° |
| CAB | CAA | CAF | 119.7° | 120.2° |
| CAA | CAB | H11 | 120.3° | 118.5° |
| CAB | CAA | H12 | 120.2° | 119.9° |
| CAC | CAD | CAG | 126.5° | 125.6° |
| CAC | CAD | CAE | 118.5° | 117.0° |
| CAA | CAF | CAE | 120.5° | 116.4° |
| CAA | CAF | NAK | 132.2° | 136.7° |
| CAF | CAA | H12 | 120.1° | 120.0° |
| CAG | CAD | CAE | 114.9° | 117.3° |
| CAD | CAG | CAH | 119.6° | 118.9° |
| CAD | CAG | H13 | 120.2° | 120.6° |
| CAD | CAE | CAF | 123.7° | 125.2° |
| CAD | CAE | CAJ | 126.7° | 124.2° |
| CAG | CAH | CAI | 120.8° | 123.0° |
| CAH | CAG | H13 | 120.2° | 120.6° |
| CAG | CAH | H14 | 119.6° | 118.5° |
| CAE | CAF | NAK | 107.3° | 106.9° |
| CAF | CAE | CAJ | 109.6° | 110.6° |
| CAF | NAK | CAN | 129.4° | 124.9° |
| CAF | NAK | CAL | 108.4° | 110.2° |
| CAE | CAJ | CAI | 118.5° | 116.9° |
| CAE | CAJ | CAL | 106.8° | 104.3° |
| CAH | CAI | CAJ | 119.3° | 119.7° |
| CAI | CAH | H14 | 119.6° | 118.5° |
| CAH | CAI | H15 | 120.3° | 120.2° |
| CAO | CAN | NAK | 107.6° | 109.5° |
| CAO | CAN | H16 | 109.9° | 109.5° |
| CAO | CAN | H17 | 109.9° | 109.5° |
| CAN | CAO | H18 | 109.5° | 109.5° |
| CAN | CAO | H19 | 109.5° | 109.4° |
| CAN | CAO | H20 | 109.5° | 109.5° |
| CAN | NAK | CAL | 122.2° | 124.9° |
| NAK | CAN | H16 | 110.0° | 109.4° |
| NAK | CAN | H17 | 109.9° | 109.4° |
| NAK | CAL | CAJ | 107.8° | 108.0° |
| NAK | CAL | OAM | 121.9° | 126.0° |
| CAI | CAJ | CAL | 134.7° | 138.9° |
| CAJ | CAI | H15 | 120.3° | 120.1° |
| CAJ | CAL | OAM | 129.9° | 126.0° |
| H1 | CAW | H2 | 109.5° | 109.4° |
| H1 | CAW | H3 | 109.5° | 109.5° |
| H2 | CAW | H3 | 109.4° | 109.5° |
| H4 | CAV | H5 | 109.5° | 109.5° |
| H6 | CAS | H7 | 109.5° | 109.5° |
| H8 | CAR | H9 | 109.4° | 109.4° |
| H16 | CAN | H17 | 109.5° | 109.5° |
| H18 | CAO | H19 | 109.5° | 109.5° |
| H18 | CAO | H20 | 109.5° | 109.5° |
| H19 | CAO | H20 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAU | SAQ | OAT | CAR | 117.5° | 131.5° |
| OAU | SAQ | OAT | NAP | 121.9° | 116.8° |
| OAU | SAQ | CAR | NAP | 118.9° | 111.7° |
| OAU | SAQ | CAR | CAS | 55.0° | 68.4° |
| OAU | SAQ | NAP | CAC | 167.7° | 176.2° |
| OAU | SAQ | CAR | H8 | 64.5° | 51.7° |
| OAU | SAQ | CAR | H9 | 174.5° | 171.6° |
| OAU | SAQ | NAP | H10 | 70.6° | 3.9° |
| OAT | SAQ | CAR | NAP | 120.6° | 111.6° |
| OAT | SAQ | CAR | CAS | 175.5° | 68.3° |
| OAT | SAQ | NAP | CAC | 68.1° | 56.0° |
| OAT | SAQ | CAR | H8 | 56.0° | 171.6° |
| OAT | SAQ | CAR | H9 | 65.1° | 51.7° |
| OAT | SAQ | NAP | H10 | 53.5° | 123.9° |
| CAS | CAV | CAW | H4 | 118.8° | 120.0° |
| CAS | CAV | CAW | H5 | 118.8° | 120.0° |
| CAV | CAS | CAR | SAQ | 171.8° | 180.0° |
| CAV | CAS | CAR | H6 | 118.9° | 120.0° |
| CAV | CAS | CAR | H7 | 118.9° | 120.0° |
| CAS | CAV | CAW | H1 | 180.0° | 180.0° |
| CAS | CAV | CAW | H2 | 60.0° | 60.0° |
| CAS | CAV | CAW | H3 | 60.0° | 60.0° |
| CAS | CAV | H4 | H5 | 123.4° | 120.0° |
| CAV | CAS | H6 | H7 | 123.2° | 120.0° |
| CAV | CAS | CAR | H8 | 52.4° | 60.0° |
| CAV | CAS | CAR | H9 | 68.7° | 60.0° |
| CAW | CAV | CAS | CAR | 172.4° | 180.0° |
| CAV | CAW | H1 | H2 | 120.0° | 119.9° |
| CAV | CAW | H1 | H3 | 120.0° | 120.0° |
| CAV | CAW | H2 | H3 | 120.0° | 120.0° |
| CAW | CAV | H4 | H5 | 123.4° | 120.0° |
| CAW | CAV | CAS | H6 | 68.7° | 60.0° |
| CAW | CAV | CAS | H7 | 53.5° | 60.0° |
| SAQ | CAR | CAS | H8 | 119.5° | 120.0° |
| SAQ | CAR | CAS | H9 | 119.5° | 120.0° |
| CAR | SAQ | NAP | CAC | 49.2° | 60.1° |
| SAQ | CAR | CAS | H6 | 53.0° | 60.0° |
| SAQ | CAR | CAS | H7 | 69.3° | 60.0° |
| SAQ | CAR | H8 | H9 | 121.6° | 119.9° |
| CAR | SAQ | NAP | H10 | 170.8° | 120.0° |
| CAS | CAR | SAQ | NAP | 63.9° | 180.0° |
| CAR | CAS | CAV | H4 | 68.7° | 60.0° |
| CAR | CAS | CAV | H5 | 53.6° | 60.0° |
| CAR | CAS | H6 | H7 | 123.2° | 120.0° |
| CAS | CAR | H8 | H9 | 121.6° | 120.0° |
| SAQ | NAP | CAC | H10 | 121.6° | 180.0° |
| SAQ | NAP | CAC | CAB | 40.8° | 35.5° |
| SAQ | NAP | CAC | CAD | 140.7° | 144.8° |
| NAP | SAQ | CAR | H8 | 176.7° | 60.0° |
| NAP | SAQ | CAR | H9 | 55.6° | 60.0° |
| NAP | CAC | CAB | CAD | 178.5° | 179.7° |
| NAP | CAC | CAB | CAA | 179.4° | 179.9° |
| NAP | CAC | CAD | CAG | 1.6° | 0.0° |
| NAP | CAC | CAD | CAE | 178.3° | 179.7° |
| NAP | CAC | CAB | H11 | 0.6° | 0.0° |
| CAC | CAB | CAA | H11 | 180.0° | 180.0° |
| CAC | CAB | CAA | CAF | 1.1° | 0.0° |
| CAB | CAC | CAD | CAG | 177.0° | 179.7° |
| CAB | CAC | CAD | CAE | 0.3° | 0.6° |
| CAB | CAC | NAP | H10 | 80.8° | 144.5° |
| CAC | CAB | CAA | H12 | 178.9° | 179.9° |
| CAA | CAB | CAC | CAD | 0.9° | 0.3° |
| CAB | CAA | CAF | H12 | 180.0° | 179.9° |
| CAB | CAA | CAF | CAE | 0.1° | 0.0° |
| CAB | CAA | CAF | NAK | 178.7° | 180.0° |
| CAC | CAD | CAG | CAE | 176.8° | 179.7° |
| CAC | CAD | CAG | CAH | 179.5° | 180.0° |
| CAC | CAD | CAE | CAF | 1.4° | 0.6° |
| CAC | CAD | CAE | CAJ | 179.3° | 179.8° |
| CAD | CAC | NAP | H10 | 97.7° | 35.2° |
| CAD | CAC | CAB | H11 | 179.1° | 179.7° |
| CAC | CAD | CAG | H13 | 0.5° | 0.1° |
| CAA | CAF | CAE | CAD | 1.2° | 0.3° |
| CAA | CAF | CAE | NAK | 178.9° | 180.0° |
| CAA | CAF | CAE | CAJ | 179.4° | 180.0° |
| CAA | CAF | NAK | CAN | 0.3° | 0.0° |
| CAA | CAF | NAK | CAL | 178.6° | 180.0° |
| CAF | CAA | CAB | H11 | 178.9° | 180.0° |
| CAD | CAG | CAH | H13 | 180.0° | 179.9° |
| CAG | CAD | CAE | CAF | 178.5° | 179.7° |
| CAG | CAD | CAE | CAJ | 2.2° | 0.1° |
| CAD | CAG | CAH | CAI | 3.5° | 0.1° |
| CAD | CAG | CAH | H14 | 176.4° | 180.0° |
| CAE | CAD | CAG | CAH | 2.6° | 0.3° |
| CAD | CAE | CAF | CAJ | 179.4° | 179.7° |
| CAD | CAE | CAF | NAK | 177.7° | 179.7° |
| CAD | CAE | CAJ | CAI | 2.5° | 0.4° |
| CAD | CAE | CAJ | CAL | 179.2° | 179.7° |
| CAE | CAD | CAG | H13 | 177.3° | 179.8° |
| CAG | CAH | CAI | H14 | 180.0° | 180.0° |
| CAG | CAH | CAI | CAJ | 3.7° | 0.5° |
| CAG | CAH | CAI | H15 | 176.3° | 180.0° |
| CAE | CAF | NAK | CAN | 178.5° | 180.0° |
| CAE | CAF | NAK | CAL | 2.6° | 0.0° |
| CAF | CAE | CAJ | CAI | 178.1° | 179.2° |
| CAF | CAE | CAJ | CAL | 0.2° | 0.1° |
| CAE | CAF | CAA | H12 | 179.9° | 179.9° |
| NAK | CAF | CAE | CAJ | 1.7° | 0.1° |
| CAF | NAK | CAN | CAO | 83.6° | 90.0° |
| CAF | NAK | CAN | CAL | 178.8° | 180.0° |
| CAF | NAK | CAL | CAJ | 2.5° | 0.0° |
| CAF | NAK | CAL | OAM | 176.2° | 180.0° |
| NAK | CAF | CAA | H12 | 1.3° | 0.0° |
| CAF | NAK | CAN | H16 | 156.7° | 150.0° |
| CAF | NAK | CAN | H17 | 36.1° | 30.1° |
| CAE | CAJ | CAI | CAH | 3.0° | 0.7° |
| CAE | CAJ | CAL | NAK | 1.4° | 0.0° |
| CAE | CAJ | CAI | CAL | 177.7° | 179.0° |
| CAE | CAJ | CAL | OAM | 174.5° | 180.0° |
| CAE | CAJ | CAI | H15 | 177.0° | 179.8° |
| CAH | CAI | CAJ | H15 | 180.0° | 179.6° |
| CAH | CAI | CAJ | CAL | 179.2° | 179.6° |
| CAI | CAH | CAG | H13 | 176.4° | 180.0° |
| CAO | CAN | NAK | H16 | 119.7° | 120.0° |
| CAO | CAN | NAK | H17 | 119.7° | 120.0° |
| CAO | CAN | NAK | CAL | 97.6° | 90.0° |
| CAO | CAN | H16 | H17 | 120.9° | 120.0° |
| CAN | CAO | H18 | H19 | 120.0° | 120.0° |
| CAN | CAO | H18 | H20 | 120.0° | 120.1° |
| CAN | CAO | H19 | H20 | 120.0° | 120.0° |
| CAN | NAK | CAL | CAJ | 178.5° | 180.0° |
| CAN | NAK | CAL | OAM | 4.8° | 0.0° |
| NAK | CAN | H16 | H17 | 120.9° | 119.9° |
| NAK | CAN | CAO | H18 | 180.0° | 180.0° |
| NAK | CAN | CAO | H19 | 60.0° | 60.0° |
| NAK | CAN | CAO | H20 | 60.0° | 60.0° |
| NAK | CAL | CAJ | CAI | 179.4° | 179.0° |
| NAK | CAL | CAJ | OAM | 173.1° | 180.0° |
| CAL | NAK | CAN | H16 | 22.1° | 30.0° |
| CAL | NAK | CAN | H17 | 142.7° | 149.9° |
| CAI | CAJ | CAL | OAM | 7.6° | 1.0° |
| CAJ | CAI | CAH | H14 | 176.3° | 179.5° |
| CAL | CAJ | CAI | H15 | 0.8° | 0.8° |
| H1 | CAW | H2 | H3 | 120.0° | 120.0° |
| H1 | CAW | CAV | H4 | 61.2° | 60.0° |
| H1 | CAW | CAV | H5 | 61.1° | 60.0° |
| H2 | CAW | CAV | H4 | 178.8° | 60.0° |
| H2 | CAW | CAV | H5 | 58.9° | 179.9° |
| H3 | CAW | CAV | H4 | 58.8° | 180.0° |
| H3 | CAW | CAV | H5 | 178.8° | 60.0° |
| H4 | CAV | CAS | H6 | 50.1° | 180.0° |
| H4 | CAV | CAS | H7 | 172.4° | 60.0° |
| H5 | CAV | CAS | H6 | 172.5° | 60.0° |
| H5 | CAV | CAS | H7 | 65.3° | 180.0° |
| H6 | CAS | CAR | H8 | 66.5° | 180.0° |
| H6 | CAS | CAR | H9 | 172.4° | 60.0° |
| H7 | CAS | CAR | H8 | 171.3° | 60.0° |
| H7 | CAS | CAR | H9 | 50.2° | 180.0° |
| H11 | CAB | CAA | H12 | 1.1° | 0.0° |
| H13 | CAG | CAH | H14 | 3.6° | 0.0° |
| H14 | CAH | CAI | H15 | 3.7° | 0.0° |
| H16 | CAN | CAO | H18 | 60.3° | 60.0° |
| H16 | CAN | CAO | H19 | 59.7° | 180.0° |
| H16 | CAN | CAO | H20 | 179.7° | 60.0° |
| H17 | CAN | CAO | H18 | 60.3° | 60.0° |
| H17 | CAN | CAO | H19 | 179.7° | 60.0° |
| H17 | CAN | CAO | H20 | 59.7° | 180.0° |
| H18 | CAO | H19 | H20 | 120.0° | 120.0° |
