0SL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAD | CAP | doub | 1.21Å | 1.25Å | |
| CAM | CAL | sing | 1.53Å | 1.51Å | |
| CAM | CAT | sing | 1.53Å | 1.53Å | |
| CAL | CAN | sing | 1.53Å | 1.55Å | |
| CAP | CAT | sing | 1.51Å | 1.54Å | |
| CAP | OAA | sing | 1.34Å | 1.28Å | |
| CAT | CAO | sing | 1.53Å | 1.51Å | |
| CAN | NAU | sing | 1.47Å | 1.48Å | |
| CAO | NAU | sing | 1.47Å | 1.49Å | |
| CAE | CAH | doub | 1.36Å | 1.39Å | Aromatic |
| CAE | CAF | sing | 1.39Å | 1.40Å | Aromatic |
| NAU | SAV | sing | 1.66Å | 1.71Å | |
| CAH | CAR | sing | 1.40Å | 1.41Å | Aromatic |
| CAF | CAI | doub | 1.36Å | 1.41Å | Aromatic |
| CAR | CAJ | doub | 1.40Å | 1.38Å | Aromatic |
| CAR | CAS | sing | 1.42Å | 1.41Å | Aromatic |
| CAI | CAS | sing | 1.40Å | 1.38Å | Aromatic |
| CAJ | CAG | sing | 1.36Å | 1.39Å | Aromatic |
| CAS | CAK | doub | 1.40Å | 1.41Å | Aromatic |
| CAG | CAQ | doub | 1.39Å | 1.40Å | Aromatic |
| CAK | CAQ | sing | 1.36Å | 1.38Å | Aromatic |
| CAQ | SAV | sing | 1.76Å | 1.66Å | |
| SAV | OAB | doub | 1.42Å | 1.48Å | |
| SAV | OAC | doub | 1.42Å | 1.50Å | |
| CAK | H1 | sing | 1.08Å | 1.08Å | |
| CAI | H2 | sing | 1.08Å | 1.08Å | |
| CAF | H3 | sing | 1.08Å | 1.08Å | |
| CAE | H4 | sing | 1.08Å | 1.08Å | |
| CAH | H5 | sing | 1.08Å | 1.08Å | |
| CAJ | H6 | sing | 1.08Å | 1.08Å | |
| CAG | H7 | sing | 1.08Å | 1.08Å | |
| CAO | H8 | sing | 1.09Å | 1.10Å | |
| CAO | H9 | sing | 1.09Å | 1.10Å | |
| CAN | H10 | sing | 1.09Å | 1.10Å | |
| CAN | H11 | sing | 1.09Å | 1.10Å | |
| CAL | H12 | sing | 1.09Å | 1.10Å | |
| CAL | H13 | sing | 1.09Å | 1.10Å | |
| CAM | H14 | sing | 1.09Å | 1.10Å | |
| CAM | H15 | sing | 1.09Å | 1.10Å | |
| CAT | H16 | sing | 1.09Å | 1.10Å | |
| OAA | H17 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAD | CAP | CAT | 115.6° | 120.0° |
| OAD | CAP | OAA | 127.1° | 120.0° |
| CAL | CAM | CAT | 112.2° | 109.5° |
| CAM | CAL | CAN | 113.7° | 109.3° |
| CAM | CAL | H12 | 108.4° | 109.5° |
| CAM | CAL | H13 | 108.4° | 109.5° |
| CAL | CAM | H14 | 108.8° | 109.5° |
| CAL | CAM | H15 | 108.8° | 109.5° |
| CAM | CAT | CAP | 111.1° | 109.5° |
| CAM | CAT | CAO | 113.5° | 109.3° |
| CAT | CAM | H14 | 108.8° | 109.3° |
| CAT | CAM | H15 | 108.8° | 109.7° |
| CAM | CAT | H16 | 107.7° | 109.5° |
| CAL | CAN | NAU | 113.6° | 108.8° |
| CAL | CAN | H10 | 108.4° | 109.5° |
| CAL | CAN | H11 | 108.4° | 109.7° |
| CAN | CAL | H12 | 108.4° | 109.5° |
| CAN | CAL | H13 | 108.4° | 109.5° |
| CAT | CAP | OAA | 116.9° | 120.0° |
| CAP | CAT | CAO | 108.5° | 109.3° |
| CAP | CAT | H16 | 107.7° | 109.6° |
| CAP | OAA | H17 | 109.5° | 117.0° |
| CAT | CAO | NAU | 110.7° | 108.8° |
| CAT | CAO | H8 | 109.1° | 109.6° |
| CAT | CAO | H9 | 109.2° | 109.7° |
| CAO | CAT | H16 | 108.1° | 109.7° |
| CAN | NAU | CAO | 120.2° | 118.8° |
| CAN | NAU | SAV | 112.2° | 120.6° |
| NAU | CAN | H10 | 108.4° | 109.7° |
| NAU | CAN | H11 | 108.4° | 109.6° |
| CAO | NAU | SAV | 110.7° | 120.7° |
| NAU | CAO | H8 | 109.1° | 109.6° |
| NAU | CAO | H9 | 109.1° | 109.6° |
| CAH | CAE | CAF | 118.3° | 121.0° |
| CAE | CAH | CAR | 118.4° | 119.7° |
| CAH | CAE | H4 | 120.9° | 119.5° |
| CAE | CAH | H5 | 120.8° | 120.2° |
| CAE | CAF | CAI | 123.0° | 121.0° |
| CAE | CAF | H3 | 118.5° | 119.5° |
| CAF | CAE | H4 | 120.8° | 119.5° |
| NAU | SAV | CAQ | 100.5° | 107.2° |
| NAU | SAV | OAB | 107.6° | 106.4° |
| NAU | SAV | OAC | 119.2° | 106.4° |
| CAH | CAR | CAJ | 117.0° | 121.3° |
| CAH | CAR | CAS | 123.0° | 119.3° |
| CAR | CAH | H5 | 120.8° | 120.1° |
| CAF | CAI | CAS | 119.0° | 119.7° |
| CAF | CAI | H2 | 120.5° | 120.1° |
| CAI | CAF | H3 | 118.5° | 119.5° |
| CAJ | CAR | CAS | 120.0° | 119.3° |
| CAR | CAJ | CAG | 119.0° | 119.6° |
| CAR | CAJ | H6 | 120.5° | 120.2° |
| CAR | CAS | CAI | 118.2° | 119.3° |
| CAR | CAS | CAK | 121.5° | 119.3° |
| CAI | CAS | CAK | 120.3° | 121.3° |
| CAS | CAI | H2 | 120.5° | 120.2° |
| CAJ | CAG | CAQ | 120.7° | 121.0° |
| CAG | CAJ | H6 | 120.5° | 120.2° |
| CAJ | CAG | H7 | 119.6° | 119.5° |
| CAS | CAK | CAQ | 116.7° | 119.7° |
| CAS | CAK | H1 | 121.7° | 120.2° |
| CAG | CAQ | CAK | 122.1° | 120.9° |
| CAG | CAQ | SAV | 114.2° | 119.5° |
| CAQ | CAG | H7 | 119.7° | 119.5° |
| CAK | CAQ | SAV | 123.6° | 119.5° |
| CAQ | CAK | H1 | 121.7° | 120.1° |
| CAQ | SAV | OAB | 104.5° | 106.4° |
| CAQ | SAV | OAC | 106.3° | 106.4° |
| OAB | SAV | OAC | 116.5° | 123.2° |
| H8 | CAO | H9 | 109.5° | 109.6° |
| H10 | CAN | H11 | 109.5° | 109.6° |
| H12 | CAL | H13 | 109.5° | 109.6° |
| H14 | CAM | H15 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAD | CAP | CAT | CAM | 22.9° | 120.0° |
| OAD | CAP | CAT | OAA | 174.2° | 180.0° |
| OAD | CAP | CAT | CAO | 148.4° | 0.2° |
| OAD | CAP | CAT | H16 | 94.9° | 119.9° |
| OAD | CAP | OAA | H17 | 0.0° | 0.1° |
| CAL | CAM | CAT | H14 | 120.4° | 119.9° |
| CAL | CAM | CAT | H15 | 120.4° | 120.2° |
| CAM | CAL | CAN | H12 | 120.6° | 119.9° |
| CAM | CAL | CAN | H13 | 120.6° | 120.0° |
| CAL | CAM | CAT | CAP | 176.2° | 178.7° |
| CAL | CAM | CAT | CAO | 61.2° | 61.6° |
| CAM | CAL | CAN | NAU | 22.1° | 54.6° |
| CAM | CAL | CAN | H10 | 142.7° | 174.4° |
| CAM | CAL | CAN | H11 | 98.5° | 65.2° |
| CAM | CAL | H12 | H13 | 118.1° | 120.2° |
| CAL | CAM | H14 | H15 | 118.8° | 120.0° |
| CAL | CAM | CAT | H16 | 58.5° | 58.5° |
| CAT | CAM | CAL | CAN | 28.0° | 61.6° |
| CAM | CAT | CAP | CAO | 125.5° | 119.7° |
| CAM | CAT | CAP | H16 | 117.7° | 120.1° |
| CAM | CAT | CAP | OAA | 163.0° | 60.0° |
| CAM | CAT | CAO | H16 | 119.4° | 120.0° |
| CAM | CAT | CAO | NAU | 37.8° | 54.7° |
| CAM | CAT | CAO | H8 | 157.9° | 65.1° |
| CAM | CAT | CAO | H9 | 82.4° | 174.6° |
| CAT | CAM | CAL | H12 | 148.6° | 58.3° |
| CAT | CAM | CAL | H13 | 92.6° | 178.5° |
| CAT | CAM | H14 | H15 | 118.8° | 120.1° |
| CAL | CAN | NAU | H10 | 120.6° | 119.8° |
| CAL | CAN | NAU | H11 | 120.6° | 119.9° |
| CAL | CAN | NAU | CAO | 47.3° | 53.3° |
| CAL | CAN | NAU | SAV | 179.9° | 126.3° |
| CAL | CAN | H10 | H11 | 118.1° | 120.4° |
| CAN | CAL | H12 | H13 | 118.1° | 120.1° |
| CAN | CAL | CAM | H14 | 148.4° | 178.6° |
| CAN | CAL | CAM | H15 | 92.4° | 58.7° |
| CAP | CAT | CAO | H16 | 116.5° | 120.1° |
| CAP | CAT | CAO | NAU | 161.9° | 174.6° |
| CAP | CAT | CAO | H8 | 78.0° | 54.8° |
| CAP | CAT | CAO | H9 | 41.7° | 65.6° |
| CAP | CAT | CAM | H14 | 55.7° | 58.8° |
| CAP | CAT | CAM | H15 | 63.4° | 61.2° |
| CAT | CAP | OAA | H17 | 173.4° | 179.9° |
| OAA | CAP | CAT | CAO | 37.5° | 179.7° |
| OAA | CAP | CAT | H16 | 79.3° | 60.1° |
| CAT | CAO | NAU | CAN | 15.7° | 53.3° |
| CAT | CAO | NAU | H8 | 120.2° | 119.8° |
| CAT | CAO | NAU | H9 | 120.2° | 120.0° |
| CAT | CAO | NAU | SAV | 149.2° | 126.3° |
| CAT | CAO | H8 | H9 | 119.4° | 120.4° |
| CAO | CAT | CAM | H14 | 178.4° | 178.5° |
| CAO | CAT | CAM | H15 | 59.2° | 58.5° |
| CAN | NAU | CAO | SAV | 133.5° | 179.7° |
| CAN | NAU | SAV | CAQ | 115.4° | 90.3° |
| CAN | NAU | SAV | OAB | 6.4° | 156.2° |
| CAN | NAU | SAV | OAC | 129.1° | 23.2° |
| CAN | NAU | CAO | H8 | 104.4° | 66.5° |
| CAN | NAU | CAO | H9 | 135.9° | 173.3° |
| NAU | CAN | H10 | H11 | 118.1° | 120.3° |
| NAU | CAN | CAL | H12 | 98.6° | 65.3° |
| NAU | CAN | CAL | H13 | 142.7° | 174.6° |
| CAO | NAU | SAV | CAQ | 107.2° | 90.0° |
| CAO | NAU | SAV | OAB | 143.8° | 23.5° |
| CAO | NAU | SAV | OAC | 8.3° | 156.4° |
| NAU | CAO | H8 | H9 | 119.4° | 120.3° |
| CAO | NAU | CAN | H10 | 167.9° | 173.1° |
| CAO | NAU | CAN | H11 | 73.3° | 66.6° |
| NAU | CAO | CAT | H16 | 81.6° | 65.3° |
| CAH | CAE | CAF | H4 | 180.0° | 180.0° |
| CAE | CAH | CAR | H5 | 180.0° | 179.9° |
| CAH | CAE | CAF | CAI | 0.8° | 0.0° |
| CAE | CAH | CAR | CAJ | 179.4° | 180.0° |
| CAE | CAH | CAR | CAS | 0.0° | 0.0° |
| CAH | CAE | CAF | H3 | 179.3° | 180.0° |
| CAF | CAE | CAH | CAR | 0.2° | 0.0° |
| CAE | CAF | CAI | H3 | 180.0° | 180.0° |
| CAE | CAF | CAI | CAS | 1.2° | 0.0° |
| CAE | CAF | CAI | H2 | 178.8° | 180.0° |
| CAF | CAE | CAH | H5 | 179.8° | 179.9° |
| NAU | SAV | CAQ | CAG | 89.8° | 90.3° |
| NAU | SAV | CAQ | CAK | 86.2° | 90.0° |
| NAU | SAV | CAQ | OAB | 111.5° | 113.5° |
| NAU | SAV | CAQ | OAC | 124.8° | 113.5° |
| NAU | SAV | OAB | OAC | 136.8° | 122.9° |
| SAV | NAU | CAO | H8 | 29.1° | 113.9° |
| SAV | NAU | CAO | H9 | 90.6° | 6.4° |
| SAV | NAU | CAN | H10 | 59.3° | 6.6° |
| SAV | NAU | CAN | H11 | 59.5° | 113.8° |
| CAH | CAR | CAJ | CAS | 179.4° | 180.0° |
| CAH | CAR | CAS | CAI | 0.4° | 0.0° |
| CAH | CAR | CAJ | CAG | 179.7° | 180.0° |
| CAH | CAR | CAS | CAK | 179.1° | 180.0° |
| CAR | CAH | CAE | H4 | 179.8° | 180.0° |
| CAH | CAR | CAJ | H6 | 0.3° | 0.0° |
| CAF | CAI | CAS | CAR | 1.0° | 0.0° |
| CAF | CAI | CAS | H2 | 180.0° | 180.0° |
| CAF | CAI | CAS | CAK | 179.6° | 180.0° |
| CAI | CAF | CAE | H4 | 179.2° | 180.0° |
| CAJ | CAR | CAS | CAI | 179.0° | 180.0° |
| CAR | CAJ | CAG | H6 | 180.0° | 180.0° |
| CAJ | CAR | CAS | CAK | 0.3° | 0.0° |
| CAR | CAJ | CAG | CAQ | 0.3° | 0.0° |
| CAJ | CAR | CAH | H5 | 0.6° | 0.1° |
| CAR | CAJ | CAG | H7 | 179.8° | 180.0° |
| CAR | CAS | CAI | CAK | 178.7° | 180.0° |
| CAS | CAR | CAJ | CAG | 0.8° | 0.0° |
| CAR | CAS | CAK | CAQ | 2.5° | 0.1° |
| CAR | CAS | CAK | H1 | 177.5° | 179.7° |
| CAR | CAS | CAI | H2 | 179.0° | 180.0° |
| CAS | CAR | CAH | H5 | 180.0° | 180.0° |
| CAS | CAR | CAJ | H6 | 179.2° | 180.0° |
| CAI | CAS | CAK | CAQ | 178.9° | 180.0° |
| CAI | CAS | CAK | H1 | 1.1° | 0.3° |
| CAS | CAI | CAF | H3 | 178.9° | 180.0° |
| CAJ | CAG | CAQ | H7 | 180.0° | 180.0° |
| CAJ | CAG | CAQ | CAK | 2.6° | 0.0° |
| CAJ | CAG | CAQ | SAV | 178.7° | 179.7° |
| CAS | CAK | CAQ | CAG | 3.6° | 0.1° |
| CAS | CAK | CAQ | H1 | 180.0° | 179.7° |
| CAS | CAK | CAQ | SAV | 179.3° | 179.7° |
| CAK | CAS | CAI | H2 | 0.4° | 0.0° |
| CAG | CAQ | CAK | SAV | 175.7° | 179.7° |
| CAG | CAQ | SAV | OAB | 21.7° | 23.2° |
| CAG | CAQ | SAV | OAC | 145.4° | 156.2° |
| CAG | CAQ | CAK | H1 | 176.4° | 179.7° |
| CAQ | CAG | CAJ | H6 | 179.8° | 180.0° |
| CAK | CAQ | SAV | OAB | 162.4° | 156.5° |
| CAK | CAQ | SAV | OAC | 38.6° | 23.5° |
| CAK | CAQ | CAG | H7 | 177.4° | 180.0° |
| CAQ | SAV | OAB | OAC | 116.9° | 123.0° |
| SAV | CAQ | CAK | H1 | 0.7° | 0.0° |
| SAV | CAQ | CAG | H7 | 1.4° | 0.3° |
| H2 | CAI | CAF | H3 | 1.1° | 0.0° |
| H3 | CAF | CAE | H4 | 0.8° | 0.0° |
| H4 | CAE | CAH | H5 | 0.2° | 0.0° |
| H6 | CAJ | CAG | H7 | 0.2° | 0.0° |
| H8 | CAO | CAT | H16 | 38.5° | 174.9° |
| H9 | CAO | CAT | H16 | 158.2° | 54.5° |
| H10 | CAN | CAL | H12 | 22.0° | 54.5° |
| H10 | CAN | CAL | H13 | 96.7° | 65.6° |
| H11 | CAN | CAL | H12 | 140.8° | 174.8° |
| H11 | CAN | CAL | H13 | 22.1° | 54.7° |
| H12 | CAL | CAM | H14 | 91.0° | 61.5° |
| H12 | CAL | CAM | H15 | 28.2° | 178.6° |
| H13 | CAL | CAM | H14 | 27.8° | 58.7° |
| H13 | CAL | CAM | H15 | 147.0° | 61.3° |
| H14 | CAM | CAT | H16 | 61.9° | 61.3° |
| H15 | CAM | CAT | H16 | 178.9° | 178.7° |
